SCHEMBL372886

SCHEMBL372886

O=C1C(=Cc2cccnc2)N2CCC1CC2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 1.00
ALDH1A1 P00352 7/20 0.69
KDM4E B2RXH2 1/20 0.69
CHRNB2 P17787 1/20 0.55
CHRNB4 P30926 1/20 0.55
CHRNA3 P32297 1/20 0.55
CHRNA4 P43681 1/20 0.55
THRB P10828 1/20 0.54
MAPK1 P28482 4/20 0.53
MAPT P10636 7/20 0.52
LMNA P02545 4/20 0.52
GAA P10253 1/20 0.52
HPGD P15428 2/20 0.50
HTT P42858 3/20 0.46
RAB9A P51151 3/20 0.46
MITF O75030 2/20 0.46
ATM Q13315 2/20 0.46
NPC1 O15118 1/20 0.46
NSD2 O96028 1/20 0.46
CNR1 P21554 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13732440 1.00 SMN1; SMN2 (1.00) SMN1; SMN2ALDH1A1KDM4ECHRNB2CHRNB4
SCHEMBL372885 1.00 SMN1; SMN2 (1.00) SMN1; SMN2ALDH1A1KDM4ECHRNB2CHRNB4
Potassium Ion SCHEMBL3805984 0.97 SMN1; SMN2 (0.95) SMN1; SMN2ALDH1A1KDM4ECHRNB2CHRNB4
SCHEMBL703829 0.92 SMN1; SMN2 (0.85) SMN1; SMN2ALDH1A1KDM4ECHRNB2CHRNB4
SCHEMBL703830 0.92 SMN1; SMN2 (0.85) SMN1; SMN2ALDH1A1KDM4ECHRNB2CHRNB4
SCHEMBL6152811 0.84 SMN1; SMN2 (0.70) SMN1; SMN2ALDH1A1KDM4ECHRNB2CHRNB4
SCHEMBL6152809 0.84 SMN1; SMN2 (0.70) SMN1; SMN2ALDH1A1KDM4ECHRNB2CHRNB4
SCHEMBL20959749 0.82 ALDH1A1 (0.71) SMN1; SMN2ALDH1A1KDM4ECHRNB2CHRNB4
SCHEMBL1331513 0.82 ALDH1A1 (0.71) SMN1; SMN2ALDH1A1KDM4ECHRNB2CHRNB4
SCHEMBL1331516 0.82 ALDH1A1 (0.71) SMN1; SMN2ALDH1A1KDM4ECHRNB2CHRNB4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 75 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250270203-A1 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS PHILIP MORRIS PRODUCTS S.A. (CH) 2025-08-28 US disclosed
CN-119212992-A Nicotinic acetylcholine receptor ligands 菲利普莫里斯生产公司 2024-12-27 CN disclosed
WO-2023213740-A1 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS PHILIP MORRIS PRODUCTS S.A. (CH) 2023-11-09 WO disclosed
US-10059704-B2 1,4-disubstituted 1,2,3-triazoles, methods for preparing same, and diagnostic and therapeutic uses thereof CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2018-08-28 US disclosed
EP-2699570-B1 1,4-DISUBSTITUTED 1,2,3-TRIAZOLES, THEIR PREPARATION PROCESSES AND THEIR DIAGNOSTIC AND THERAPEUTIC USES CENTRE NAT RECH SCIENT (FR) 2018-08-22 EP disclosed
EP-2431037-B1 (2S,3R)-N-(2-((3-pyridinyl)methyl)-1-azabicyclo[2.2.2]oct-3-yl)benzofuran-2-carboxamide, novel salt forms, and methods of use thereof ATTENUA INC (US) 2016-11-30 EP disclosed
EP-2465501-B1 Method for the preparation of (2S,3R)-N-(2-((3-pyridinyl)methyl)-1-azabicyclo[2.2.2]oct-3-yl)benzofuran-2-carboxamide ATTENUA INC (US) 2016-10-05 EP disclosed
US-20150045386-A1 (2S,3R)-N-2-3-PYRIDINYLMETHYL-1-AZABICYCLO 2.2.2 OCT-3-YL BENZOFURAN-2-CARBOXAMIDE, NOVEL SALT FORMS, AND METHODS OF USE THEREOF ATTENUA, INC. 2015-02-12 US disclosed
US-8846715-B2 (2S,3R)-N-(2((3-pyridinyl)methyl)-1-azabicyclo[2.2.2]oct-3-yl)benzofuran-2-carboxamide novel salt forms, and methods of use thereof TARGACEPT, INC. (US) 2014-09-30 US disclosed
US-20140234270-A1 TREATMENT WTH ALPHAT SELECTIVE LIGANDS TARGACEPT, INC. (US) 2014-08-21 US disclosed
US-20060247270-A1 e.g. 2-((3-pyridinyl)methyl)-1-azabicyclo[2.2.2]oct-3-yl N-phenylcarbamate; nicotinic acetylcholine receptors alpha 7 (nAChRs)/neurotransmitter modulator; diagnostic radiolabel; central nervous systrem disorders, autoimmune diseases; antiinflammatory, antitumor agents, angiogenesis inhibitor ATTENUA, INC. 2006-11-02 US disclosed
US-20050255040-A1 3-Substituted-2(arylalkyl)-1-azabicycloalkanes and methods of use thereof ATTENUA, INC. 2005-11-17 US disclosed
EP-1594869-A2 3-SUBSTITUTED-2(ARYLALKYL)-1-AZABICYCLOALKANES AND METHODS OF USE THEREOF Targacept, Inc. (US) 2005-11-16 EP disclosed
US-6953855-B2 3-substituted-2(arylalkyl)-1-azabicycloalkanes and methods of use thereof TARGACEPT, INC. (US) 2005-10-11 US disclosed
WO-2004076449-A2 3-SUBSTITUTED-2(ARYLALKYL)-1-AZABICYCLOALKANES AND METHODS OF USE THEREOF TARGACEPT, INC. (US) 2004-09-10 WO disclosed
US-20040002513-A1 3-Substituted-2(arylalkyl)-1-azabicycloalkanes and methods of use thereof ATTENUA, INC. 2004-01-01 US disclosed
US-20030045523-A1 Nicotinic cholinergic receptor antagonists SCHMITT JEFFREY DANIEL (US) 2003-03-06 US disclosed
US-6432975-B1 AROMATIC ALKYLENE AZOBICYCLIC COMPOUNDS AS NICOTINIC RECEPTOR ANTAGONISTS; ANTIDEPRESSANTS; NERVOUS SYSTEM DISORDER TREATMENT TARGACEPT, INC. 2002-08-13 US disclosed
EP-1053236-A1 PYRDIYL-BRIIDGEHEAD DERIVATIVES AND THEIR ANALOGUES, PHARMACEUTICAL COMPOSITIONS AND THEIR USE AS INHIBITORS OF NICOTINIC CHOLINERGIC RECEPTORS R.J. REYNOLDS TOBACCO COMPANY (US) 2000-11-22 EP disclosed
WO-2000034276-A1 PYRIDYL-BRIDGEHEAD DERIVATIVES AND THEIR ANALOGUES, PHARMACEUTICAL COMPOSITIONS AND THEIR USE AS INHIBITORS OF NICOTINIC CHOLINERGIC RECEPTORS R.J. REYNOLDS TOBACCO COMPANY (US) 2000-06-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250270203-A1 NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS CHRNA7, CHRNA1, CHRNA6 SMN1; SMN2 431/4885ALDH1A1 1029/4885KDM4E 4228/4885
US-10059704-B2 1,4-disubstituted 1,2,3-triazoles, methods for preparing same, and diagnostic and therapeutic uses thereof CYP3A43, NAT1, UGT1A1 SMN1; SMN2 3860/4885ALDH1A1 258/4885KDM4E 4144/4885
US-20030045523-A1 Nicotinic cholinergic receptor antagonists CHRNG, CHRNB1, CHRNA1 SMN1; SMN2 2009/4885ALDH1A1 1668/4885KDM4E 1520/4885
US-20140234270-A1 TREATMENT WTH ALPHAT SELECTIVE LIGANDS CHRNA7, CHRNA2, CHRNA4 SMN1; SMN2 525/4885ALDH1A1 1381/4885KDM4E 3190/4885
US-20060247270-A1 e.g. 2-((3-pyridinyl)methyl)-1-azabicyclo[2.2.2]oct-3-yl N-phenylcarbamate; nicotinic acetylcholine receptors alpha 7 (nAChRs)/neurotransmitter modulator; diagnostic radiolabel; central nervous systrem disorders, autoimmune diseases; antiinflammatory, antitumor agents, angiogenesis inhibitor CHRM1, CHRNA7, CHRM3 SMN1; SMN2 1217/4885ALDH1A1 1672/4885KDM4E 1584/4885
US-20150045386-A1 (2S,3R)-N-2-3-PYRIDINYLMETHYL-1-AZABICYCLO 2.2.2 OCT-3-YL BENZOFURAN-2-CARBOXAMIDE, NOVEL SALT FORMS, AND METHODS OF USE THEREOF HCN3, HCN2, NTSR2 SMN1; SMN2 117/4885ALDH1A1 913/4885KDM4E 1626/4885
US-20040002513-A1 3-Substituted-2(arylalkyl)-1-azabicycloalkanes and methods of use thereof CHRNA7, CHRNA3, CHRNA1 SMN1; SMN2 3112/4885ALDH1A1 1036/4885KDM4E 1804/4885
US-20050255040-A1 3-Substituted-2(arylalkyl)-1-azabicycloalkanes and methods of use thereof CHRNA7, CHRNA3, CHRNA5 SMN1; SMN2 3222/4885ALDH1A1 882/4885KDM4E 1934/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.