SCHEMBL7770355

SCHEMBL7770355

COC=C(C(=O)O)c1ccccc1C

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ERCC5 P28715 1/20 0.46
FEN1 P39748 1/20 0.46
HPGD P15428 2/20 0.43
RAB9A P51151 3/20 0.41
NPC1 O15118 2/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
GPR52 Q9Y2T5 1/20 0.40
MYC P01106 1/20 0.40
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 2/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL7770353 1.00 ERCC5 (0.46) ERCC5FEN1HPGDRAB9ANPC1
SCHEMBL6265289 1.00 ERCC5 (0.46) ERCC5FEN1HPGDRAB9ANPC1
SCHEMBL714219 0.85 ALDH1A1 (0.56) HPGDRAB9ANPC1ALDH1A1SMN1; SMN2
SCHEMBL5998808 0.84 NPC1 (0.43) ERCC5FEN1HPGDRAB9ANPC1
SCHEMBL1426474 0.84 NPC1 (0.43) ERCC5FEN1HPGDRAB9ANPC1
SCHEMBL1426471 0.84 NPC1 (0.43) ERCC5FEN1HPGDRAB9ANPC1
SCHEMBL9492649 0.83 ERCC5 (0.44) ERCC5FEN1HPGDRAB9ANPC1
SCHEMBL9492641 0.83 ERCC5 (0.44) ERCC5FEN1HPGDRAB9ANPC1
SCHEMBL3122880 0.82 LMNA (0.52) HPGDNPC1CA12CA1CA2
SCHEMBL3122885 0.82 LMNA (0.52) HPGDNPC1CA12CA1CA2

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0656880-B1 CHEMICAL PROCESS ZENECA LTD (GB) 1997-10-15 EP claimed
CN-1129573-C Preparation method of 2- (2-methylphenyl) -3-methoxy methyl acrylate BASF AG (DE) 2003-12-03 CN disclosed
CN-1129573-C Preparation method of 2- (2-methylphenyl) -3-methoxy methyl acrylate BASF AG (DE) 2003-12-03 CN disclosed
EP-0888280-B1 PROCESS FOR PREPARING 2-(2-METHYLPHENYL)-3-METHOXYACRYLIC ACID METHYLESTER BASF AG (DE) 2001-08-29 EP disclosed
EP-0888280-B1 PROCESS FOR PREPARING 2-(2-METHYLPHENYL)-3-METHOXYACRYLIC ACID METHYLESTER BASF AG (DE) 2001-08-29 EP disclosed
US-6162945-A Process for preparing 2-(2-methylphenyl)-3-methoxyacrylic acid methylester BASF AKTIENGESELLSCHAFT (DE) 2000-12-19 US disclosed
EP-0299694-B1 Acrylate fungicides AVENTIS CROPSCIENCE UK LTD (GB) 2000-10-11 EP disclosed
CN-1206401-A Process for preparing 2-(2-methylphenyl)-3-methoxyacrylic acid methylester BASF AG (DE) 1999-01-27 CN disclosed
CN-1206401-A Process for preparing 2-(2-methylphenyl)-3-methoxyacrylic acid methylester BASF AG (DE) 1999-01-27 CN disclosed
EP-0888280-A1 PROCESS FOR PREPARING 2-(2-METHYLPHENYL)-3-METHOXYACRYLIC ACID METHYLESTER BASF AKTIENGESELLSCHAFT (DE) 1999-01-07 EP disclosed
EP-0656879-A1 CHEMICAL PROCESS. ZENECA LTD (GB) 1995-06-14 EP disclosed
EP-0656880-A1 CHEMICAL PROCESS. ZENECA LTD (GB) 1995-06-14 EP disclosed
US-5332752-A Acrylate fungicides SCHERING AGROCHEMICALS LIMITED (GB) 1994-07-26 US disclosed
US-5304530-A Insecticides, miticides, aracidides SCHERING AGROCHEMICALS LIMITED (GB) 1994-04-19 US disclosed
WO-1994005620-A1 CHEMICAL PROCESS ZENECA LIMITED (GB) 1994-03-17 WO disclosed
WO-1994005622-A1 CHEMICAL PROCESS ZENECA LIMITED (GB) 1994-03-17 WO disclosed
US-5192357-A ACRYLATE FUNGICIDES SCHERING AGROCHEMICALS LIMITED (GB) 1993-03-09 US disclosed
EP-0378308-A1 Acrylate fungicides AgrEvo UK Limited (GB) 1990-07-18 EP disclosed
EP-0331966-A1 Substituted acrylic-acid esters BAYER AG (DE) 1989-09-13 EP disclosed
EP-0299694-A2 Acrylate fungicides AgrEvo UK Limited (GB) 1989-01-18 EP disclosed