SCHEMBL9159296

SCHEMBL9159296

C=C(CCc1ccc(O)c(C(=O)O)c1)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 2/20 0.63
KLKB1 P03952 1/20 0.59
CTSB P07858 1/20 0.59
MMP9 P14780 1/20 0.59
DNMT1 P26358 1/20 0.59
DNMT3B Q9UBC3 1/20 0.59
DNMT3L Q9UJW3 1/20 0.59
DNMT3A Q9Y6K1 1/20 0.59
KAT8 Q9H7Z6 2/20 0.55
EGFR P00533 1/20 0.55
HNF4A P41235 2/20 0.53
MCL1 Q07820 2/20 0.48
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
PTGS2 P35354 2/20 0.46
CA12 O43570 1/20 0.46
ALOX5 P09917 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46

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
SCHEMBL3383712 0.85 IAPP (0.57) LCKALOX5KDM4EALDH1A1HPGD
SCHEMBL9689519 0.83 LCK (0.71) LCKKLKB1CTSBMMP9DNMT1
SCHEMBL10950033 0.82 LCK (0.89) LCKKLKB1CTSBMMP9DNMT1
SCHEMBL30790801 0.81 LCK (0.85) LCKKLKB1CTSBMMP9DNMT1
SCHEMBL10902984 0.77 KAT8 (0.67) LCKKLKB1CTSBMMP9DNMT1
SCHEMBL28761882 0.76 LCK (0.71) LCKKLKB1CTSBMMP9DNMT1
SCHEMBL29178595 0.76 LCK (0.77) LCKKLKB1CTSBMMP9DNMT1
SCHEMBL2534915 0.76 KAT8 (0.76) LCKKLKB1CTSBMMP9DNMT1
SCHEMBL31236856 0.76 LCK (0.71) LCKKLKB1CTSBMMP9DNMT1
SCHEMBL28444886 0.76 LCK (0.71) LCKKLKB1CTSBMMP9DNMT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0376460-B1 Liquid electrophotographic toner MINNESOTA MINING & MFG (US) 1995-02-22 EP disclosed
EP-0376460-A1 Liquid electrophotographic toner MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1990-07-04 EP disclosed