SCHEMBL17464264

SCHEMBL17464264

O=C1CCC(=O)c2c1c(O)c1c(C(=O)O)ccc(C(=O)O)c1c2O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.50
SELL P14151 1/20 0.42
SELP P16109 1/20 0.42
LDHA P00338 1/20 0.40
WDR5 P61964 1/20 0.37
FTO Q9C0B1 1/20 0.37
ALDH1A1 P00352 6/20 0.36
TSHR P16473 3/20 0.36
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA7 P43166 2/20 0.36
CA9 Q16790 2/20 0.36
CA14 Q9ULX7 2/20 0.36
HSD17B10 Q99714 4/20 0.36
HPGD P15428 3/20 0.36
THRB P10828 1/20 0.36
CYP2C9 P11712 1/20 0.36
ALOX12 P18054 1/20 0.36
ATIC P31939 1/20 0.36

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
SCHEMBL16089352 0.93 SELL (0.46) CYP1A2SELLSELPLDHAWDR5
SCHEMBL16089349 0.86 PARP1 (0.42) CYP1A2LDHAALDH1A1TSHRCA12
SCHEMBL17464265 0.74 PIM1 (0.50) CYP1A2ALDH1A1HSD17B10HPGDTHRB
SCHEMBL17464273 0.71 CSNK2A2 (0.39) ALDH1A1HSD17B10HPGDTHRBKDM4E
SCHEMBL31218584 0.70 KDM4E (0.61) CYP1A2ALDH1A1TSHRHSD17B10HPGD
SCHEMBL29612818 0.70 KDM4E (0.61) CYP1A2ALDH1A1TSHRHSD17B10HPGD
SCHEMBL375358 0.70 KDM4E (0.61) CYP1A2ALDH1A1TSHRHSD17B10HPGD
SCHEMBL29417502 0.69 CYP1A2 (1.00) CYP1A2SELLSELPLDHAWDR5
SCHEMBL22122 0.69 CYP1A2 (1.00) CYP1A2SELLSELPLDHAWDR5
SCHEMBL17464268 0.69 MAPT (0.42) CYP1A2ALDH1A1TSHRCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9804512-B2 Electrophotographic photosensitive member, method for producing electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2017-10-31 US disclosed
US-9804512-B2 Electrophotographic photosensitive member, method for producing electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2017-10-31 US disclosed
US-20160026099-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, METHOD FOR PRODUCING ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KABUSHIKI KAISHA (JP) 2016-01-28 US disclosed
US-20160026099-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, METHOD FOR PRODUCING ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KABUSHIKI KAISHA (JP) 2016-01-28 US disclosed