SCHEMBL9797944

SCHEMBL9797944

O=C(O)c1ccccc1/C=C/c1ccc(F)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 7/20 0.58
BCL2L1 Q07817 1/20 0.57
BAD Q92934 1/20 0.57
SNCA P37840 3/20 0.56
TRPA1 O75762 1/20 0.56
GRIK1 P39086 1/20 0.55
GRIA1 P42261 1/20 0.55
GRIA2 P42262 1/20 0.55
GRIA3 P42263 1/20 0.55
GRIA4 P48058 1/20 0.55
GRIK2 Q13002 1/20 0.55
GRIK3 Q13003 1/20 0.55
MAOA P21397 1/20 0.51
MAOB P27338 1/20 0.51
ALDH1A1 P00352 2/20 0.50
LMNA P02545 1/20 0.50
TP53 P04637 1/20 0.50
PTPN1 P18031 1/20 0.47
HNF4A P41235 1/20 0.47
HSD11B1 P28845 1/20 0.47

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
SCHEMBL10496469 1.00 NFE2L2 (0.58) NFE2L2BCL2L1BADSNCATRPA1
SCHEMBL2291774 0.87 GRIK1 (0.58) NFE2L2BCL2L1BADTRPA1GRIK1
SCHEMBL29542528 0.87 GRIK1 (0.58) NFE2L2BCL2L1BADTRPA1GRIK1
SCHEMBL13554389 0.87 GRIK1 (0.58) NFE2L2BCL2L1BADTRPA1GRIK1
SCHEMBL1019981 0.87 GRIK1 (0.58) NFE2L2BCL2L1BADTRPA1GRIK1
Hydrochloric Acid SCHEMBL26105180 0.85 GRIK1 (0.56) NFE2L2BCL2L1BADTRPA1GRIK1
SCHEMBL68552 0.84 GRIK1 (0.56) TRPA1GRIK1GRIA1GRIA2GRIA3
SCHEMBL68551 0.84 GRIK1 (0.56) TRPA1GRIK1GRIA1GRIA2GRIA3
SCHEMBL8902281 0.83 ALDH1A1 (0.62) TRPA1GRIK1GRIA1GRIA2GRIA3
SCHEMBL70202 0.83 ALDH1A1 (0.62) TRPA1GRIK1GRIA1GRIA2GRIA3

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-0275501-B1 PROCESS FOR THE PREPARATION OF (Z)-2-(2-ARYLETHENYL)-ARYLCARBOXYLIC ACIDS BASF Aktiengesellschaft (DE) 1991-03-06 EP disclosed
US-4857658-A Preparation of (Z)-2-(2-arylethenyl)arylcarboxylic acids BASF AKTIENGESELLSCHAFT (DE) 1989-08-15 US disclosed
EP-0275501-A1 Process for the preparation of (Z)-2-(2-arylethenyl)-arylcarboxylic acids BASF Aktiengesellschaft (DE) 1988-07-27 EP disclosed