SCHEMBL16404204

SCHEMBL16404204

Cc1nc(C(=O)Nc2cccc3ccccc23)c(C)n1-c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 9/20 0.67
CNR2 P34972 9/20 0.67
MDM2 Q00987 1/20 0.56
GRM5 P41594 6/20 0.53
CYP1A2 P05177 2/20 0.52
CYP3A4 P08684 2/20 0.52
CYP2D6 P10635 2/20 0.52
CYP2C19 P33261 2/20 0.52
NPC1 O15118 1/20 0.52
CYP2C9 P11712 1/20 0.52
RAB9A P51151 1/20 0.52
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49
MAPT P10636 2/20 0.49
NTRK1 P04629 1/20 0.49
HPGD P15428 1/20 0.49
L3MBTL1 Q9Y468 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
SCHEMBL16404246 0.87 CNR1 (0.61) CNR1CNR2MDM2CYP1A2CYP3A4
SCHEMBL16404257 0.86 CNR1 (0.60) CNR1CNR2GRM5KDM4EALDH1A1
SCHEMBL16404212 0.86 CNR2 (0.66) CNR1CNR2MDM2CYP1A2CYP3A4
SCHEMBL16404241 0.85 CNR1 (0.61) CNR1CNR2MDM2GRM5CYP1A2
SCHEMBL16404206 0.84 CNR1 (0.60) CNR1CNR2GRM5
SCHEMBL5999099 0.83 CNR1 (0.65) CNR1CNR2GRM5NPC1RAB9A
SCHEMBL16404252 0.82 CNR1 (0.57) CNR1CNR2GRM5
SCHEMBL2033217 0.81 CNR1 (0.65) CNR1CNR2GRM5RAB9AALDH1A1
SCHEMBL16404232 0.79 CNR2 (0.56) CNR1CNR2MDM2CYP1A2CYP3A4
SCHEMBL16404230 0.79 CNR2 (0.66) CNR1CNR2MDM2CYP1A2CYP3A4

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
US-8937184-B2 1H-imidazole derivatives as cannabinoid CB2 receptor modulators ABBVIE B.V. (NL) 2015-01-20 US disclosed
US-8937184-B2 1H-imidazole derivatives as cannabinoid CB2 receptor modulators ABBVIE B.V. (NL) 2015-01-20 US disclosed