SCHEMBL256935

SCHEMBL256935

Cc1nn2c(-c3ccc(F)c(F)c3)cc(N3CCC[C@H]3CO)nc2c1-c1ccc(O)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 1/20 0.38
SCN9A Q15858 1/20 0.38
EGLN2 Q96KS0 2/20 0.35
MAP2K7 O14733 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
BCL6 P41182 1/20 0.35
TP53 P04637 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 2/20 0.34
LMNA P02545 1/20 0.34
KDM4E B2RXH2 1/20 0.34
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
HSD17B10 Q99714 1/20 0.34
SOS1 Q07889 2/20 0.34
ITGB2 P05107 2/20 0.34
ICAM1 P05362 2/20 0.34

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
SCHEMBL15020743 0.94 LMNA (0.40) FPR2SCN9AEGLN2ADORA2AADORA1
SCHEMBL257396 0.94 LMNA (0.40) FPR2SCN9AEGLN2ADORA2AADORA1
SCHEMBL15020893 0.93 TP53 (0.43) FPR2SCN9ATP53MAPTHPGD
SCHEMBL257702 0.91 FPR2 (0.36) FPR2SCN9AEGLN2ADORA2AADORA1
SCHEMBL257511 0.91 MAPT (0.45) FPR2SCN9AADORA2AADORA1MAPT
SCHEMBL15021446 0.91 MAPT (0.45) FPR2SCN9AADORA2AADORA1MAPT
SCHEMBL15020597 0.89 FPR2 (0.40) FPR2SCN9AEGLN2MAPTHPGD
SCHEMBL15020600 0.89 FPR2 (0.40) FPR2SCN9AEGLN2MAPTHPGD
SCHEMBL15020802 0.88 LMNA (0.39) FPR2SCN9AEGLN2ADORA2AADORA1
SCHEMBL15020911 0.86 FPR2 (0.41) FPR2SCN9AEGLN2ADORA2AADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012030170-A2 NOVEL COMPOUND ACTING AS A CANNABINOID RECEPTOR-1 INHIBITOR (주)아모레퍼시픽 (KR) 2012-03-08 WO disclosed