SCHEMBL3477996

SCHEMBL3477996

Cn1ccc2cc(-c3ccc(O)c(N)c3)ccc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.54
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.47
USP2 O75604 1/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
HSP90AA1 P07900 1/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
HPGD P15428 1/20 0.47
ALOX15 P16050 1/20 0.47
ALOX12 P18054 1/20 0.47
HTT P42858 1/20 0.47
KMT2A Q03164 1/20 0.47
HSD17B10 Q99714 1/20 0.47
AR P10275 1/20 0.47
PIK3CB P42338 2/20 0.46
LRRK2 Q5S007 2/20 0.46
HSD11B1 P28845 1/20 0.46
CYP2A6 P11509 1/20 0.42

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
SCHEMBL14046188 0.80 CYP2A6 (0.54) PRKCIALDH1A1ALOX15HSD17B10AR
SCHEMBL28318034 0.80 PRKCI (0.52) PRKCIARLRRK2HSD11B1CYP2A6
SCHEMBL27768998 0.79 PPM1B (0.50) PRKCIKDM4EKMT2AARLRRK2
SCHEMBL20660663 0.79 ALDH1A1 (0.57) PRKCIALDH1A1ARPIK3CBLRRK2
SCHEMBL981889 0.75 PRKCI (0.66) PRKCIARPIK3CBLRRK2HSD11B1
SCHEMBL28318035 0.74 HSD11B1 (0.52) PRKCIKDM4EMEN1ALDH1A1MAPT
SCHEMBL28822417 0.74 ALDH1A1 (0.77) KDM4EMEN1USP2ALDH1A1LMNA
SCHEMBL29367250 0.74 ALDH1A1 (0.77) KDM4EMEN1USP2ALDH1A1LMNA
SCHEMBL108713 0.74 ALDH1A1 (0.77) KDM4EMEN1USP2ALDH1A1LMNA
SCHEMBL30241674 0.74 HSD11B1 (0.69) PRKCILRRK2HSD11B1CYP2A6FASN

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
WO-2010039186-A2 COMPOUNDS USEFUL AS FAAH MODULATORS AND USES THEREOF RENOVIS, INC. (US) 2010-04-08 WO disclosed
WO-2010039186-A2 COMPOUNDS USEFUL AS FAAH MODULATORS AND USES THEREOF RENOVIS, INC. (US) 2010-04-08 WO disclosed