SCHEMBL8635549

SCHEMBL8635549

CCOc1ccc(C=CC(=O)Nc2ccccc2C(N)=O)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.70
RAB9A P51151 9/20 0.70
MEN1 O00255 8/20 0.70
SMN1; SMN2 Q16637 8/20 0.70
NPC1 O15118 8/20 0.70
KDM4E B2RXH2 4/20 0.70
LMNA P02545 2/20 0.70
POLB P06746 1/20 0.70
ALDH1A1 P00352 4/20 0.66
HPGD P15428 3/20 0.66
NPSR1 Q6W5P4 1/20 0.66
TNIK Q9UKE5 1/20 0.65
PKM P14618 1/20 0.63
EGFR P00533 2/20 0.62
MAPT P10636 4/20 0.60
TRPA1 O75762 2/20 0.60
CYP2C19 P33261 2/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
MAPK1 P28482 2/20 0.56

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
SCHEMBL8635541 1.00 KMT2A (0.70) KMT2ARAB9AMEN1SMN1; SMN2NPC1
SCHEMBL8638570 0.87 SMN1; SMN2 (0.65) KMT2ARAB9AMEN1SMN1; SMN2NPC1
SCHEMBL8638566 0.87 SMN1; SMN2 (0.65) KMT2ARAB9AMEN1SMN1; SMN2NPC1
SCHEMBL8640680 0.86 NPC1 (0.79) KMT2ARAB9AMEN1SMN1; SMN2NPC1
SCHEMBL8640672 0.86 NPC1 (0.79) KMT2ARAB9AMEN1SMN1; SMN2NPC1
SCHEMBL8639755 0.83 ALDH1A1 (0.69) KMT2ARAB9AMEN1SMN1; SMN2NPC1
SCHEMBL8639760 0.83 ALDH1A1 (0.69) KMT2ARAB9AMEN1SMN1; SMN2NPC1
SCHEMBL8636709 0.82 ALDH1A1 (0.71) KMT2ARAB9AMEN1SMN1; SMN2NPC1
SCHEMBL8636716 0.82 ALDH1A1 (0.71) KMT2ARAB9AMEN1SMN1; SMN2NPC1
SCHEMBL8638075 0.82 SMN1; SMN2 (1.00) KMT2ARAB9AMEN1SMN1; SMN2NPC1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0855387-A1 2-ACYLAMINOBENZAMIDE DERIVATIVES AND PREVENTIVE AND REMEDY FOR DISEASES CAUSED BY THE SUPERMULTIPLICATION OF VASCULAR INTIMAL CELLS KISSEI PHARMACEUTICAL CO., LTD. (JP) 1998-07-29 EP disclosed