SCHEMBL31521259

SCHEMBL31521259

C=CC(=O)c1ccccc1-c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 1/20 0.57
GPR52 Q9Y2T5 1/20 0.53
AKT1 P31749 1/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
CHRNB2 P17787 3/20 0.50
CHRNB4 P30926 3/20 0.50
CHRNA3 P32297 3/20 0.50
CHRNA4 P43681 3/20 0.50
HNF4A P41235 1/20 0.48
TSHR P16473 1/20 0.47
RECQL P46063 1/20 0.47
HSP90AA1 P07900 1/20 0.46
SCN1A P35498 2/20 0.45
SCN2A Q99250 2/20 0.45
SCN3A Q9NY46 2/20 0.45
FABP3 P05413 1/20 0.44
FABP4 P15090 1/20 0.44
FABP5 Q01469 1/20 0.44

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
SCHEMBL5180034 1.00 BCAT2 (0.57) BCAT2GPR52AKT1MEN1KMT2A
SCHEMBL229857 0.85 HNF4A (0.47) BCAT2GPR52AKT1MEN1KMT2A
SCHEMBL7864455 0.82 BCAT2 (0.59) BCAT2GPR52MEN1KMT2ASMN1; SMN2
SCHEMBL6040927 0.80 HNF4A (0.54) BCAT2GPR52AKT1MEN1KMT2A
SCHEMBL10347642 0.80 AKT1 (0.61) AKT1MEN1KMT2ASMN1; SMN2TSHR
Butadiene SCHEMBL491698 0.80 HNF4A (0.58) BCAT2GPR52MEN1KMT2ASMN1; SMN2
SCHEMBL1901065 0.79 BCAT2 (0.52) BCAT2GPR52MEN1KMT2ASMN1; SMN2
SCHEMBL28479627 0.79 MAPT (0.40) BCAT2GPR52AKT1KMT2ARECQL
SCHEMBL28340415 0.78 GPR52 (0.59) BCAT2GPR52MEN1KMT2ASMN1; SMN2
Propene SCHEMBL29138948 0.78 HNF4A (0.56) BCAT2MEN1KMT2ASMN1; SMN2CHRNB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119790331-A Polarizing plate and optical display device 三星SDI株式会社 2025-04-08 CN disclosed