SCHEMBL699692

SCHEMBL699692

Fc1ccc(Cn2cc3ccccc3n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.46
MAPT P10636 5/20 0.44
LMNA P02545 3/20 0.44
TBXA2R P21731 1/20 0.43
KMT2A Q03164 1/20 0.41
PARP1 P09874 1/20 0.40
HTR3A P46098 2/20 0.40
HTR3E A5X5Y0 1/20 0.40
HTR3B O95264 1/20 0.40
HTR1A P08908 1/20 0.40
HTR2C P28335 1/20 0.40
HTR3D Q70Z44 1/20 0.40
HTR3C Q8WXA8 1/20 0.40
KDM4E B2RXH2 4/20 0.40
ALDH1A1 P00352 2/20 0.40
GAA P10253 2/20 0.40
CACNA1G O43497 1/20 0.40
CACNA1H O95180 1/20 0.40
CACNA1I Q9P0X4 1/20 0.40
NPC1 O15118 1/20 0.39

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
SCHEMBL19475067 0.86 PARP1 (0.51) KMT2APARP1HTR2C
SCHEMBL693201 0.83 DRD2 (0.46) MAPTPARP1KDM4EALDH1A1
SCHEMBL15687354 0.78 MAPT (0.40) MAPTLMNAKMT2ACACNA1GCACNA1H
SCHEMBL694658 0.78 MAPT (0.40) RAB9AMAPTLMNATBXA2RKMT2A
SCHEMBL695221 0.78 MAPT (0.40) RAB9AMAPTLMNATBXA2RKMT2A
SCHEMBL25238008 0.78 RIPK1 (0.49) RAB9AMAPTLMNAKMT2AKDM4E
SCHEMBL1852868 0.75 GRM2 (0.45) RAB9AMAPTLMNATBXA2RKMT2A
SCHEMBL2625741 0.75 GRM2 (0.51) RAB9AMAPTLMNAKMT2APARP1
SCHEMBL3556931 0.75 HDAC2 (0.58) RAB9AALDH1A1NPC1
SCHEMBL21917561 0.74 MET (0.48) KMT2AGAA

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-2421851-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica, N.V. (BE) 2012-02-29 EP claimed
WO-2010124102-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO claimed