SCHEMBL11530588

SCHEMBL11530588

O=CC(=O)c1cc(-c2ccccc2)ccc1-c1ccc(-c2ccc(-c3ccccc3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACMSD Q8TDX5 3/20 0.49
▸ HNF4A P41235 2/20 0.49
▸ DHFR P00374 1/20 0.49
▸ MCL1 Q07820 1/20 0.49
▸ PTPN1 P18031 3/20 0.46
▸ IKBKB O14920 1/20 0.46
▸ GSTA1 P08263 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ EGFR P00533 1/20 0.43
▸ BCAT2 O15382 1/20 0.43
▸ FOLH1 Q04609 1/20 0.42
▸ ATM Q13315 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ APAF1 O14727 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ THRB P10828 1/20 0.42

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
SCHEMBL11568765 1.00 ACMSD (0.49) ACMSDHNF4ADHFRMCL1PTPN1
SCHEMBL11536804 0.94 PTPN1 (0.45) ACMSDHNF4ADHFRMCL1PTPN1
SCHEMBL11530624 0.93 ACMSD (0.51) ACMSDHNF4ADHFRMCL1PTPN1
SCHEMBL11528529 0.92 ATM (0.46) ACMSDHNF4ADHFRMCL1PTPN1
SCHEMBL11530033 0.83 BCAT2 (0.46) HNF4APTPN1ALDH1A1MAPK1TDP1
SCHEMBL11312027 0.82 GSTA1 (0.53) ACMSDHNF4ADHFRMCL1PTPN1
SCHEMBL7864455 0.81 BCAT2 (0.59) HNF4AALDH1A1MAPK1TDP1BCAT2
SCHEMBL593979 0.81 ACMSD (0.66) ACMSDHNF4ADHFRMCL1PTPN1
SCHEMBL11527797 0.80 ALDH1A1 (0.52) ACMSDHNF4ADHFRMCL1PTPN1
SCHEMBL11528988 0.80 ALDH1A1 (0.52) ACMSDHNF4ADHFRMCL1PTPN1

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
US-4147728-A Disubstituted meta-terphenyl compounds and resulting polymers INSTITUT FRANCAIS DU PETROLE (FR) 1979-04-03 — — US disclosed
US-4064176-A Di-substituted meta-terphenyl compounds and resulting polymers INSTITUT FRANCAIS DU PETROLE (FR) 1977-12-20 — — US disclosed
US-4045414-A New di-substituted meta-terphenyl compounds and resulting polymers INSTITUT FRANCAIS DU PETROLE (FR) 1977-08-30 — — US disclosed
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