SCHEMBL9160643

SCHEMBL9160643

CC(c1cccc(Cc2ccccc2)c1)c1ccc(O)c(C(=O)O)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HNF4A P41235 2/20 0.64
ACMSD Q8TDX5 5/20 0.60
KLKB1 P03952 1/20 0.54
CTSB P07858 1/20 0.54
MMP9 P14780 1/20 0.54
DNMT1 P26358 1/20 0.54
DNMT3B Q9UBC3 1/20 0.54
DNMT3L Q9UJW3 1/20 0.54
DNMT3A Q9Y6K1 1/20 0.54
KDM4E B2RXH2 4/20 0.46
ALDH1A1 P00352 4/20 0.46
HPGD P15428 4/20 0.46
HSD17B10 Q99714 4/20 0.46
TDP1 Q9NUW8 2/20 0.46
CYP2C19 P33261 2/20 0.46
CYP2C9 P11712 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
GRM1 Q13255 1/20 0.46
IDH1 O75874 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
SCHEMBL658651 0.85 KDM4E (0.56) HNF4AACMSDKDM4EALDH1A1HPGD
SCHEMBL1373696 0.85 KDM4E (0.56) HNF4AACMSDKDM4EALDH1A1HPGD
SCHEMBL5964731 0.84 KDM4E (0.54) HNF4AACMSDKDM4EALDH1A1HPGD
SCHEMBL2833452 0.82 KDM4E (0.62) HNF4AACMSDKLKB1CTSBMMP9
SCHEMBL5884677 0.82 ACMSD (0.62) HNF4AACMSDKDM4EALDH1A1HPGD
SCHEMBL11755689 0.81 CA1 (0.53) HNF4AACMSDKLKB1CTSBMMP9
SCHEMBL1373695 0.81 HNF4A (0.52) HNF4AACMSDKLKB1CTSBMMP9
SCHEMBL5697821 0.80 CSNK2A1 (0.57) HNF4AACMSDKDM4EALDH1A1HPGD
SCHEMBL27396608 0.79 HNF4A (1.00) HNF4AACMSDKLKB1CTSBMMP9
SCHEMBL5446640 0.79 HNF4A (1.00) HNF4AACMSDKLKB1CTSBMMP9

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
US-5382560-A Metal salt of styrene-salicyclic acid compound SANYO CHEMICAL INDUSTRIES, LTD. (JP) 1995-01-17 US disclosed