SCHEMBL16404240

SCHEMBL16404240

Cc1nc(C(=O)NCc2cccnc2)c(C)n1-c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.59
CNR2 P34972 3/20 0.59
KMT2A Q03164 3/20 0.59
ALDH1A1 P00352 3/20 0.55
HPGD P15428 2/20 0.55
ALOX15 P16050 1/20 0.55
TSHR P16473 1/20 0.55
DUSP3 P51452 1/20 0.55
HSD17B10 Q99714 1/20 0.55
TP53 P04637 1/20 0.54
MEN1 O00255 1/20 0.54
GAA P10253 1/20 0.54
USP2 O75604 1/20 0.53
POLB P06746 1/20 0.52
RAB9A P51151 1/20 0.52
HTT P42858 2/20 0.50
MMP13 P45452 1/20 0.50

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
SCHEMBL16404239 0.80 CNR2 (0.60) CNR1CNR2TP53RAB9A
SCHEMBL16404254 0.77 CNR1 (0.56) CNR1CNR2KMT2AALDH1A1TP53
SCHEMBL16404211 0.75 CNR1 (0.68) CNR1CNR2
SCHEMBL16404224 0.74 CNR1 (1.00) CNR1CNR2KMT2AHPGDMEN1
SCHEMBL22543080 0.73 MAPT (0.68) KMT2AALDH1A1HPGDALOX15TSHR
SCHEMBL1161997 0.73 NAMPT (0.75) KMT2AALDH1A1GAAUSP2HTT
SCHEMBL2424556 0.72 RECQL (0.72) KMT2AALDH1A1HPGDUSP2HTT
SCHEMBL12629886 0.72 POLB (0.64) KMT2AALDH1A1HPGDTSHRGAA
SCHEMBL13102334 0.72 MMP13 (0.85) KMT2AALDH1A1HPGDTSHRGAA
SCHEMBL29437161 0.72 MMP13 (0.85) KMT2AALDH1A1HPGDTSHRGAA

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