SCHEMBL16404254

SCHEMBL16404254

COc1ccc(CNC(=O)c2nc(C)n(-c3ccccc3)c2C)cc1OC

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.56
CNR2 P34972 2/20 0.56
SMN1; SMN2 Q16637 1/20 0.55
KMT2A Q03164 3/20 0.54
MEN1 O00255 2/20 0.54
NOD2 Q9HC29 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.52
ALDH1A1 P00352 1/20 0.50
APEX1 P27695 1/20 0.50
MAPT P10636 2/20 0.49
TP53 P04637 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
SCHEMBL16404240 0.77 CNR1 (0.59) CNR1CNR2KMT2AMEN1ALDH1A1
SCHEMBL582322 0.75 SMN1; SMN2 (0.85) SMN1; SMN2L3MBTL1ALDH1A1APEX1
SCHEMBL16404239 0.75 CNR2 (0.60) CNR1CNR2MAPTTP53
SCHEMBL2936661 0.73 ALDH1A1 (0.78) SMN1; SMN2KMT2AMEN1ALDH1A1APEX1
SCHEMBL16404211 0.72 CNR1 (0.68) CNR1CNR2
SCHEMBL4961512 0.72 CNR1 (0.55) CNR1CNR2SMN1; SMN2KMT2AMEN1
SCHEMBL16404224 0.72 CNR1 (1.00) CNR1CNR2KMT2AMEN1
SCHEMBL17194791 0.71 SMN1; SMN2 (1.00) SMN1; SMN2
SCHEMBL17695175 0.70 ALDH1A1 (0.64) SMN1; SMN2KMT2AMEN1NOD2L3MBTL1
SCHEMBL1078509 0.70 TP53 (0.58) CNR1CNR2KMT2AMEN1ALDH1A1

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