SCHEMBL7536655

SCHEMBL7536655

Oc1cccc(CN2CCC(C(O)c3ccccc3)CC2)c1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.61
CYP1A2 P05177 1/20 0.61
CYP3A4 P08684 1/20 0.61
CYP2D6 P10635 1/20 0.61
TSHR P16473 1/20 0.61
HTR2A P28223 1/20 0.61
HTR2C P28335 1/20 0.61
DRD2 P14416 1/20 0.56
SIGMAR1 Q99720 1/20 0.53
CARM1 Q86X55 1/20 0.52
PRMT6 Q96LA8 1/20 0.52
CHRM2 P08172 1/20 0.49
CHRM3 P20309 1/20 0.49

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
SCHEMBL10989753 0.77 DRD2 (0.60) KDM4EDRD2SIGMAR1CHRM2CHRM3
SCHEMBL9720716 0.77 OPRD1 (0.70) CYP1A2CYP3A4CYP2D6HTR2ADRD2
Glemanserin SCHEMBL120012 0.76 HTR2A (1.00) KDM4ECYP1A2CYP3A4CYP2D6TSHR
SCHEMBL1505839 0.76 SLC6A3 (0.67)
SCHEMBL23198112 0.76 DRD2 (0.58) DRD2SIGMAR1CHRM2CHRM3
SCHEMBL10370183 0.76 ACHE (0.65) KDM4EDRD2SIGMAR1CHRM2CHRM3
SCHEMBL17967991 0.76 DRD2 (0.58) DRD2SIGMAR1PRMT6CHRM2CHRM3
SCHEMBL30516676 0.75 SIGMAR1 (0.61) KDM4ECYP1A2CYP3A4CYP2D6TSHR
SCHEMBL25273950 0.75 KDM4E (0.56) KDM4ECYP1A2CYP3A4CYP2D6TSHR
SCHEMBL31207846 0.75 CARM1 (0.68) KDM4ECYP1A2CYP3A4CYP2D6TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1032569-A1 IMIDAZOLE DERIVATIVES, PREPARATION AND THERAPEUTIC APPLICATION THEREOF SANOFI-SYNTHELABO (FR) 2000-09-06 EP claimed
WO-1999025710-A1 IMIDAZOLE DERIVATIVES, PREPARATION AND THERAPEUTIC APPLICATION THEREOF SANOFI-SYNTHELABO (FR) 1999-05-27 WO claimed