SCHEMBL16404232

SCHEMBL16404232

Cc1c(C(=O)Nc2cccc3ccccc23)ncn1-c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.56
CNR1 P21554 2/20 0.56
MDM2 Q00987 1/20 0.55
CYP1A2 P05177 2/20 0.51
CYP3A4 P08684 2/20 0.51
CYP2D6 P10635 2/20 0.51
CYP2C19 P33261 2/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
CYP2C9 P11712 1/20 0.51
NPY5R Q15761 1/20 0.48
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 3/20 0.48
MAPT P10636 2/20 0.48
NTRK1 P04629 2/20 0.48
HPGD P15428 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47

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
SCHEMBL16404196 0.80 KDM4E (0.51) CNR2CNR1MDM2CYP1A2CYP3A4
SCHEMBL16404204 0.79 CNR1 (0.67) CNR2CNR1MDM2CYP1A2CYP3A4
SCHEMBL16404246 0.76 CNR1 (0.61) CNR2CNR1MDM2CYP1A2CYP3A4
SCHEMBL28499436 0.76 KDM4E (0.66) CYP1A2CYP3A4CYP2D6CYP2C19NPC1
SCHEMBL16404241 0.74 CNR1 (0.61) CNR2CNR1MDM2CYP1A2CYP3A4
SCHEMBL16142598 0.74 HTT (0.51) CNR2ALDH1A1HPGD
SCHEMBL16404230 0.73 CNR2 (0.66) CNR2CNR1MDM2CYP1A2CYP3A4
SCHEMBL16404212 0.73 CNR2 (0.66) CNR2CNR1MDM2CYP1A2CYP3A4
SCHEMBL24004514 0.71 SMN1; SMN2 (0.63) CNR2CNR1CYP1A2CYP3A4CYP2D6
SCHEMBL28491241 0.70 KDM4E (0.54) CNR2CNR1CYP1A2CYP3A4CYP2D6

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