SCHEMBL7987177

SCHEMBL7987177

O=C1c2ccccc2C(=O)N1Cc1ccccc1CO

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 1/20 0.49
CA12 O43570 1/20 0.48
CA9 Q16790 1/20 0.48
GRM5 P41594 1/20 0.48
KMT2A Q03164 3/20 0.47
ALDH1A1 P00352 2/20 0.47
PKM P14618 2/20 0.47
MEN1 O00255 1/20 0.47
KDM4E B2RXH2 1/20 0.45
GAA P10253 1/20 0.45
RECQL P46063 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
RPS6KA2 Q15349 1/20 0.45
GLS O94925 1/20 0.44
GABRA1 P14867 1/20 0.44
GABRG2 P18507 1/20 0.44
GABRB3 P28472 1/20 0.44
GABRA5 P31644 1/20 0.44
GABRA3 P34903 1/20 0.44

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
SCHEMBL15624560 0.81 MPO (0.50) CASP3CA12CA9GRM5KMT2A
SCHEMBL4509679 0.81 CASP3 (0.53) CASP3CA12CA9GRM5KMT2A
SCHEMBL3213661 0.81 CASP3 (0.49) CASP3CA12CA9GRM5KMT2A
SCHEMBL5697024 0.81 MAPT (0.54) CASP3CA12CA9KMT2AALDH1A1
SCHEMBL4831304 0.79 GRM5 (0.47) CASP3CA12CA9GRM5KMT2A
SCHEMBL930356 0.79 ALDH1A1 (0.54) GRM5KMT2AALDH1A1PKMMEN1
SCHEMBL1337353 0.78 CA12 (0.57) CASP3CA12KMT2AALDH1A1MEN1
SCHEMBL8097081 0.78 CA12 (0.54) CASP3CA12CA9GRM5KMT2A
SCHEMBL17866115 0.77 CASP3 (0.53) CASP3CA12CA9GRM5KMT2A
SCHEMBL10304923 0.77 PTGS1 (0.65) CASP3CA12CA9KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6235731-B1 REDUCING BLOOD LIPIDS, SUGARS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-05-22 US disclosed
CN-1223659-A Fused imidazopyridine derivatives as antihyperlipidemic agents TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1999-07-21 CN disclosed
EP-0915888-A1 FUSED IMIDAZOPYRIDINE DERIVATIVES AS ANTIHYPERLIPIDEMIC AGENTS Takeda Chemical Industries, Ltd. (JP) 1999-05-19 EP disclosed
WO-1997040051-A1 FUSED IMIDAZOPYRIDINE DERIVATIVES AS ANTIHYPERLIPIDEMIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-10-30 WO disclosed