SCHEMBL16404223

SCHEMBL16404223

Cc1nc(C(=O)NC2CCCCCCC2)c(C)n1-c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 12/20 0.65
CNR1 P21554 12/20 0.65
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
POLB P06746 1/20 0.52
TP53 P04637 3/20 0.51
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
HPGD P15428 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
P2RX7 Q99572 1/20 0.49
ALDH1A1 P00352 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
HTT P42858 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
SCHEMBL16404255 0.82 CNR1 (0.70) CNR2CNR1KMT2A
SCHEMBL4509587 0.80 CNR1 (0.75) CNR2CNR1
SCHEMBL6702070 0.80 CNR1 (0.89) CNR2CNR1
SCHEMBL3687436 0.79 CNR2 (1.00) CNR2CNR1KMT2AHPGDSMN1; SMN2
SCHEMBL16404253 0.79 CNR1 (0.57) CNR2CNR1HTT
SCHEMBL16404210 0.78 CNR2 (0.72) CNR2CNR1HPGDSMN1; SMN2ALDH1A1
SCHEMBL6699879 0.77 CNR1 (0.77) CNR2CNR1
SCHEMBL6700636 0.77 CNR1 (0.81) CNR2CNR1
SCHEMBL2033217 0.76 CNR1 (0.65) CNR2CNR1TP53RAB9AHPGD
SCHEMBL16404261 0.75 CNR1 (0.60) CNR2CNR1POLB

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