SCHEMBL3929528

SCHEMBL3929528

c1ccc2ncc(Nc3nccc4c3CCN(CCC3CCCCC3)C4)cc2c1

nearest known ligand 0.85

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 11/20 0.85
IGF1R P08069 2/20 0.41
EGFR P00533 1/20 0.41
INSR P06213 1/20 0.41
MET P08581 1/20 0.41
CDK2 P24941 1/20 0.41
KDR P35968 1/20 0.41
TEK Q02763 1/20 0.41
DRD2 P14416 1/20 0.41
DRD3 P35462 1/20 0.41
HTR6 P50406 3/20 0.40
HTR7 P34969 2/20 0.40
TRPV1 Q8NER1 2/20 0.40
ABCB1 P08183 1/20 0.39
ABCG2 Q9UNQ0 1/20 0.39

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
SCHEMBL3936930 0.92 FAAH (1.00) FAAHIGF1REGFRINSRMET
SCHEMBL3939849 0.91 FAAH (0.98) FAAHIGF1REGFRINSRMET
SCHEMBL4012669 0.86 FAAH (0.79) FAAHIGF1REGFRINSRMET
SCHEMBL3937615 0.84 FAAH (1.00) FAAHHTR6HTR7ABCB1ABCG2
SCHEMBL4017519 0.84 FAAH (0.76) FAAHIGF1REGFRINSRMET
SCHEMBL3937880 0.83 FAAH (0.74) FAAHIGF1REGFRINSRMET
SCHEMBL3933967 0.83 FAAH (0.83) FAAHIGF1R
SCHEMBL3932151 0.83 FAAH (0.83) FAAHIGF1REGFRINSRMET
SCHEMBL3936220 0.82 FAAH (1.00) FAAH
SCHEMBL3933752 0.82 FAAH (0.89) FAAH

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
WO-2009011904-A1 COMPOUNDS USEFUL AS FAAH MODULATORS AND USES THEREOF RENOVIS, INC. (US) 2009-01-22 WO disclosed
WO-2009011904-A1 COMPOUNDS USEFUL AS FAAH MODULATORS AND USES THEREOF RENOVIS, INC. (US) 2009-01-22 WO disclosed