SCHEMBL1745374

SCHEMBL1745374

COC(=O)/C=C/c1ccc(O)cc1Cl

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 7/20 0.69
MAPT P10636 3/20 0.67
ALDH1A1 P00352 2/20 0.67
MEN1 O00255 2/20 0.67
KMT2A Q03164 2/20 0.67
KDM4E B2RXH2 1/20 0.67
TP53 P04637 1/20 0.67
CYP1A2 P05177 1/20 0.67
CYP2C9 P11712 1/20 0.67
HPGD P15428 1/20 0.67
ALOX15 P16050 1/20 0.67
CYP2C19 P33261 1/20 0.67
HSD17B10 Q99714 1/20 0.67
TTR P02766 4/20 0.59
CA12 O43570 1/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
TYR P14679 1/20 0.56
CA7 P43166 1/20 0.56
CA9 Q16790 1/20 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
SCHEMBL15888226 0.89 BACE1 (0.59) BACE1MAPTALDH1A1MEN1KMT2A
Methyl 3-(2,4-Dichlorophenyl)Acrylate SCHEMBL6315070 0.85 MAPT (0.62) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL3532294 0.85 ALDH1A1 (0.51) MAPTALDH1A1MEN1KMT2AKDM4E
Methyl 3-(2,4-Dichlorophenyl)Acrylate SCHEMBL7434845 0.85 MAPT (0.62) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL3532296 0.85 ALDH1A1 (0.51) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL14926720 0.84 MAPT (0.50) BACE1MAPTALDH1A1MEN1KMT2A
SCHEMBL7573821 0.83 ALDH1A1 (0.76) BACE1MAPTALDH1A1MEN1KMT2A
SCHEMBL29886427 0.83 ALDH1A1 (0.76) BACE1MAPTALDH1A1MEN1KMT2A
SCHEMBL29372443 0.83 BACE1 (0.63) BACE1MAPTALDH1A1MEN1KMT2A
SCHEMBL28754820 0.83 BACE1 (0.63) BACE1MAPTALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2385032-A1 GPR40 Receptor function regulator Takeda Pharmaceutical Company Limited (JP) 2011-11-09 EP disclosed
US-7960369-B2 Receptor function regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-06-14 US disclosed
CN-1735408-A Receptor function controlling agent TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2006-02-15 CN disclosed