SCHEMBL3758709

SCHEMBL3758709

Cc1cccc(CNC2CCN(C(=O)OC(C)(C)C)CC2)c1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.57
ACHE P22303 1/20 0.56
BACE1 P56817 1/20 0.56
BCHE P06276 1/20 0.51
MAPT P10636 2/20 0.50
TP53 P04637 2/20 0.50
STS P08842 1/20 0.49
KDM1A O60341 1/20 0.48
EPHX2 P34913 1/20 0.48
ALDH1A1 P00352 2/20 0.48
EPHX1 P07099 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
NPC1 O15118 1/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL4244799 0.88 GPR119 (0.61) GPR119MAPTTP53STSALDH1A1
SCHEMBL4139961 0.88 STS (0.56) MAPTTP53STSALDH1A1EPHX1
SCHEMBL4210228 0.88 CARM1 (0.55) GPR119MAPTSTSALDH1A1EPHX1
SCHEMBL15587415 0.87 ACHE (0.59) ACHEBACE1BCHEMAPTALDH1A1
SCHEMBL616004 0.87 STS (0.60) GPR119ACHEBACE1BCHEMAPT
SCHEMBL2793493 0.86 GPR119 (0.57) GPR119ACHEBACE1MAPTTP53
SCHEMBL20566961 0.86 TEAD1 (0.63) GPR119STSEPHX2NPC1MAPK1
SCHEMBL29442410 0.85 GPR119 (0.56) GPR119MAPTSTSALDH1A1EPHX1
SCHEMBL16464176 0.84 POLB (0.58) GPR119ACHEBACE1BCHEMAPT
SCHEMBL15587408 0.83 ACHE (0.63) ACHEBACE1BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230219897-A1 PYRAZOLE MAGL INHIBITORS H. LUNDBECK A/S (DK) 2023-07-13 US disclosed
US-11655217-B2 Pyrazole MAGL inhibitors H. LUNDBECK A/S (DK) 2023-05-23 US disclosed
US-9765053-B2 Methods of treatment using selective 5-HT2A inverse agonists ACADIA PHARMACEUTICALS INC. (US) 2017-09-19 US disclosed
US-20170165273-A9 METHODS OF TREATMENT USING SELECTIVE 5-HT2A INVERSE AGONISTS ANDERSSON CARL-MAGNUS A (DK) 2017-06-15 US disclosed
EP-1787984-B1 AZACYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF SEROTONIN RELATED DISEASES ACADIA PHARM INC (US) 2016-10-19 EP disclosed
US-20160237036-A1 AZACYCLIC COMPOUNDS ACADIA PHARM INC (US) 2016-08-18 US disclosed
US-9296694-B2 Azacyclic compounds ACADIA PHARMACEUTICALS INC. (US) 2016-03-29 US disclosed
US-20150259291-A1 AZACYCLIC COMPOUNDS ACADIA PHARMACEUTICALS INC. 2015-09-17 US disclosed
US-20110301191-A1 METHODS OF TREATMENT USING SELECTIVE 5-HT2A INVERSE AGONISTS ANDERSSON CARL-MAGNUS A (DK) 2011-12-08 US disclosed
US-20100298366-A1 CHEMOKINE RECEPTOR BINDING COMPOUNDS GENZYME CORPORATION (US) 2010-11-25 US disclosed
US-20060194778-A1 Serotonin receptor antagonist; psychological disorders; side effect reduction ACADIA PHARMACEUTICALS, INC. 2006-08-31 US disclosed
US-20060194834-A1 Azacyclic compounds ACADIA PHARMACEUTICALS, INC. 2006-08-31 US disclosed
US-20050014757-A1 Azacyclic compounds ANDERSSON CARL-MAGNUS A (DK) 2005-01-20 US disclosed
US-6815458-B2 NERVOUS SYSTEM DISORDERS ACADIA PHARMACEUTICALS, INC 2004-11-09 US disclosed
US-6756393-B2 AMIDES AND UREAS N-SUBSTITUTED WITH PIPERIDINE OR NORTROPANE; SEROTONIN INVERSE AGONISTS OR ANTAGONISTS; ANTIPSYCHOTIC ACADIA PHARMACEUTICALS, INC. 2004-06-29 US disclosed
US-20030220316-A1 Azacyclic compounds ACADIA PHARMACEUTICALS INC. 2003-11-27 US disclosed
CN-1443167-A Azacyclo compounds for the treatment of 5-hydroxytryptamine related disorders ACADIA PHARM INC (US) 2003-09-17 CN disclosed
EP-1263729-A1 AZACYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF SEROTONIN RELATED DISEASES Acadia Pharmaceuticals Inc. (US) 2002-12-11 EP disclosed
US-20020004513-A1 Azacyclic compounds ACADIA PHARMACEUTICALS INC. 2002-01-10 US disclosed
WO-2001066521-A1 AZACYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF SEROTONIN RELATED DISEASES ACADIA PHARMACEUTICALS, INC. (US) 2001-09-13 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 (12 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-20150259291-A1 AZACYCLIC COMPOUNDS HTR6, TPMT, HNMT GPR119 309/4885ACHE 514/4885BACE1 2560/4885
US-20110301191-A1 METHODS OF TREATMENT USING SELECTIVE 5-HT2A INVERSE AGONISTS HTR2A, HTR5A, HTR3B GPR119 180/4885ACHE 601/4885BACE1 2958/4885
US-20230219897-A1 PYRAZOLE MAGL INHIBITORS MGLL, PNLIP, LPL GPR119 308/4885ACHE 29/4885BACE1 1375/4885
US-20060194834-A1 Azacyclic compounds HTR6, HTR5A, HNMT GPR119 482/4885ACHE 662/4885BACE1 3013/4885
US-20100298366-A1 CHEMOKINE RECEPTOR BINDING COMPOUNDS CCR5, CXCR3, CCL5 GPR119 207/4885ACHE 4772/4885BACE1 3346/4885
US-20030220316-A1 Azacyclic compounds HTR6, TPMT, HNMT GPR119 309/4885ACHE 514/4885BACE1 2560/4885
US-20020004513-A1 Azacyclic compounds HTR6, TPMT, HNMT GPR119 309/4885ACHE 514/4885BACE1 2560/4885
US-20050014757-A1 Azacyclic compounds HTR6, TPMT, HNMT GPR119 309/4885ACHE 514/4885BACE1 2560/4885
US-20170165273-A9 METHODS OF TREATMENT USING SELECTIVE 5-HT2A INVERSE AGONISTS HTR2A, HTR5A, HTR3B GPR119 180/4885ACHE 601/4885BACE1 2958/4885
US-20160237036-A1 AZACYCLIC COMPOUNDS HTR6, TPMT, HNMT GPR119 309/4885ACHE 514/4885BACE1 2560/4885
US-11655217-B2 Pyrazole MAGL inhibitors MGLL, PNLIP, LPL GPR119 353/4885ACHE 37/4885BACE1 1686/4885
US-20060194778-A1 Serotonin receptor antagonist; psychological disorders; side effect reduction HTR2A, HTR1A, HTR1B GPR119 286/4885ACHE 740/4885BACE1 3517/4885

“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.