SCHEMBL3263155

SCHEMBL3263155

c1ccc(CSc2nnc(SCc3ccccc3)s2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.72
HPGD P15428 2/20 0.72
ALDH1A1 P00352 4/20 0.68
MAPT P10636 3/20 0.68
FFAR1 O14842 1/20 0.64
MAPK1 P28482 1/20 0.64
GAA P10253 2/20 0.59
PKM P14618 2/20 0.59
TSHR P16473 1/20 0.59
SMN1; SMN2 Q16637 4/20 0.58
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
CA1 P00915 1/20 0.58
NPC1 O15118 3/20 0.58
RAB9A P51151 3/20 0.58
CDK2 P24941 1/20 0.53
KDM4E B2RXH2 2/20 0.52
RECQL P46063 1/20 0.52
CDK1 P06493 1/20 0.51
CCNB1 P14635 1/20 0.51

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
SCHEMBL24700466 0.94 LMNA (0.66) LMNAHPGDALDH1A1MAPTFFAR1
SCHEMBL23137230 0.94 LMNA (0.66) LMNAHPGDALDH1A1MAPTFFAR1
SCHEMBL23137231 0.91 LMNA (0.62) LMNAHPGDALDH1A1MAPTFFAR1
SCHEMBL3906094 0.87 MAPK1 (0.62) LMNAHPGDALDH1A1MAPTFFAR1
SCHEMBL10985991 0.87 NPC1 (0.78) LMNAHPGDALDH1A1MAPTFFAR1
SCHEMBL6492979 0.87 MEN1 (0.59) LMNAHPGDALDH1A1MAPTFFAR1
SCHEMBL1720545 0.87 LMNA (0.58) LMNAHPGDALDH1A1MAPTFFAR1
SCHEMBL14582758 0.86 FFAR1 (0.72) LMNAHPGDALDH1A1MAPTFFAR1
SCHEMBL11440911 0.82 CA1 (0.66) LMNAHPGDALDH1A1FFAR1MAPK1
SCHEMBL27863757 0.82 FFAR1 (0.59) LMNAHPGDALDH1A1MAPTFFAR1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8236793-B2 Diazabicyclic aryl derivatives as cholinergic receptor modulators NEUROSEARCH A/S (DK) 2012-08-07 US disclosed
US-20100113428-A1 DIAZABICYCLIC ARYL DERIVATIVES AS CHOLINERGIC RECEPTOR MODULATORS ANIONA APS (DK) 2010-05-06 US disclosed
EP-2172469-A1 Diazabicyclic aryl derivatives as cholinergic receptor modulators NeuroSearch A/S (DK) 2010-04-07 EP disclosed
US-7662808-B2 N-[4-(1,4-Diaza-bicyclo[3.2.2]non-4-yl)-phenyl]-benzamide; disorders related to smooth muscle contraction, endocrine diseases or disorders, diseases or disorders related to neuro-degeneration, diseases or disorders related to inflammation, pain, and withdrawal symptoms caused by the termination of abuse NEUROSEARCH A/S (DK) 2010-02-16 US disclosed
EP-1713487-B1 DIAZABICYCLIC ARYL DERIVATIVES AS CHOLINERGIC RECEPTOR MODULATORS NEUROSEARCH AS (DK) 2009-12-02 EP disclosed
US-20080227773-A1 Diazabicyclic Aryl Derivatives as Cholinergic Receptor Modulators ANIONA APS (DK) 2008-09-18 US disclosed
EP-1713487-A1 DIAZABICYCLIC ARYL DERIVATIVES AS CHOLINERGIC RECEPTOR MODULATORS NEUROSEARCH A/S (DK) 2006-10-25 EP disclosed
WO-2005074940-A1 DIAZABICYCLIC ARYL DERIVATIVES AS CHOLINERGIC RECEPTOR MODULATORS NEUROSEARCH A/S (DK) 2005-08-18 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 (2 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-20100113428-A1 DIAZABICYCLIC ARYL DERIVATIVES AS CHOLINERGIC RECEPTOR MODULATORS CHRNA6, CHRNA10, CHRNA2 LMNA 2673/4885HPGD 1338/4885ALDH1A1 917/4885
US-20080227773-A1 Diazabicyclic Aryl Derivatives as Cholinergic Receptor Modulators CHRNA6, CHRNA10, CHRNA2 LMNA 2706/4885HPGD 1356/4885ALDH1A1 932/4885

“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.