SCHEMBL9797948

SCHEMBL9797948

CC(C)c1cccc(/C=C/c2ccccc2C(=O)O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.51
GRIA1 P42261 1/20 0.51
GRIA2 P42262 1/20 0.51
GRIA3 P42263 1/20 0.51
GRIA4 P48058 1/20 0.51
GRIK2 Q13002 1/20 0.51
GRIK3 Q13003 1/20 0.51
BCL2L1 Q07817 1/20 0.47
BAD Q92934 1/20 0.47
PTPN1 P18031 1/20 0.44
HNF4A P41235 1/20 0.44
NOTUM Q6P988 1/20 0.43
RXRA P19793 2/20 0.42
NR4A2 P43354 1/20 0.42
RXRB P28702 1/20 0.42
RXRG P48443 1/20 0.42
LMNA P02545 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MDM4 O15151 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL10496539 1.00 GRIK1 (0.51) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL9797931 0.81 GRIK1 (0.55) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL10496436 0.81 GRIK1 (0.55) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL16105818 0.79 AHR (0.52) RXRANR4A2KDM4EMDM4ALDH1A1
SCHEMBL2291774 0.79 GRIK1 (0.58) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL16105690 0.79 AHR (0.52) RXRANR4A2KDM4EMDM4ALDH1A1
SCHEMBL16105692 0.79 AHR (0.52) RXRANR4A2KDM4EMDM4ALDH1A1
SCHEMBL13554389 0.79 GRIK1 (0.58) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL29542528 0.79 GRIK1 (0.58) GRIK1GRIA1GRIA2GRIA3GRIA4
SCHEMBL1019981 0.79 GRIK1 (0.58) GRIK1GRIA1GRIA2GRIA3GRIA4

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