SCHEMBL7459530

SCHEMBL7459530

CC=C(C(=O)O)c1ccccc1CBr

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.37
AKR1C3 P42330 1/20 0.36
ALDH1A1 P00352 4/20 0.36
LMNA P02545 2/20 0.36
ALOX15 P16050 1/20 0.35
AKR1C1 Q04828 1/20 0.35
ERCC5 P28715 1/20 0.35
FEN1 P39748 1/20 0.35
CLCN2 P51788 1/20 0.35
PTPN1 P18031 1/20 0.34
GSK3B P49841 1/20 0.34
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
TSHR P16473 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL3459412 1.00 FOLH1 (0.37) FOLH1AKR1C3ALDH1A1LMNAALOX15
SCHEMBL7691194 0.85 ERCC5 (0.36) FOLH1AKR1C3ALDH1A1LMNAALOX15
SCHEMBL7691197 0.84 FOLH1 (0.36) FOLH1ALDH1A1LMNAALOX15CLCN2
SCHEMBL7459526 0.83 ALDH1A1 (0.39) FOLH1ALDH1A1LMNATSHR
SCHEMBL5080478 0.83 ALDH1A1 (0.39) FOLH1ALDH1A1LMNATSHR
SCHEMBL3459410 0.83 ALDH1A1 (0.39) FOLH1ALDH1A1LMNATSHR
SCHEMBL3459380 0.82 FOLH1 (0.37) FOLH1ALDH1A1LMNAALOX15AKR1C1
SCHEMBL5998860 0.82 FOLH1 (0.37) FOLH1ALDH1A1LMNAALOX15AKR1C1
SCHEMBL5669568 0.81 ALDH1A1 (0.43) ALDH1A1LMNATSHRHTT
SCHEMBL7684484 0.81 LMNA (0.33) FOLH1ALDH1A1LMNAPTPN1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2565180-A2 ALPHA-ARYLMETHOXYACRYLATE DERIVATIVE, PREPARATION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME Oscotec Inc. (KR) 2013-03-06 EP disclosed
EP-0811614-B1 Benzyloxy substituted aromatics and their use as fungicides and insecticides DOW AGROSCIENCES LLC (US) 2002-09-25 EP disclosed
EP-1070052-A1 FUNGICIDE COMPOSITIONS COMPRISING A HYDROXIMIC OR HYDRAZONIC GROUP AVENTIS CROPSCIENCE S.A. (FR) 2001-01-24 EP disclosed
EP-1021399-A2 FUNGICIDES WITH HYDROXIMIC AND HYDRAZONIC GROUPS AVENTIS CROPSCIENCE S.A. (FR) 2000-07-26 EP disclosed
US-6043282-A FUNGICIDES, PESTICIDES, INSECTICIDES, NEMATOCIDES, MITICIDES BASF AKTIENGESELLSCHAFT (DE) 2000-03-28 US disclosed
WO-1999051579-A1 FUNGICIDE COMPOSITIONS COMPRISING A HYDROXIMIC OR HYDRAZONIC GROUP AVENTIS CROPSCIENCE S.A. (FR) 1999-10-14 WO disclosed
US-5886015-A APPLYING FUNGICIDE OR INSECTICIDE TO THE LOCUS OF THE SEED, PLANT OR SOIL ROHM AND HAAS COMPANY (US) 1999-03-23 US disclosed
WO-1998015512-A2 FUNGICIDES WITH HYDROXIMIC AND HYDRAZONIC GROUPS RHONE POULENC AGROCHIMIE (FR) 1998-04-16 WO disclosed
EP-0811614-A1 Benzyloxy substituted aromatics and their use as fungicides and insecticides ROHM AND HAAS COMPANY (US) 1997-12-10 EP disclosed
US-5371268-A Ortho-substituted benzyl esters of cyclopropanecarboxylic acids BASF AKTIENGESELLSCHAFT (DE) 1994-12-06 US disclosed
EP-0532022-A1 Acrylate compound, preparation process thereof and fungicide using the same UBE INDUSTRIES, LTD. (JP) 1993-03-17 EP disclosed
US-4822908-A Substituted acrylates and fungicides containing same BASF AKTIENGESELLSCHAFT (DE) 1989-04-18 US disclosed