SCHEMBL1129161

SCHEMBL1129161

CCCCCCCCCCCCCCCCCCNC(=O)Nc1ccc(C(=O)O)c(O)c1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 10/20 0.62
ALDH1A1 P00352 2/20 0.62
HTT P42858 1/20 0.62
EPHX2 P34913 4/20 0.60
PPARA Q07869 1/20 0.53
HDAC1 Q13547 1/20 0.52
HDAC2 Q92769 1/20 0.52
GHSR Q92847 1/20 0.52
MAPT P10636 1/20 0.50

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
SCHEMBL1592352 1.00 EPHX1 (0.62) EPHX1ALDH1A1HTTEPHX2PPARA
SCHEMBL1592300 1.00 EPHX1 (0.62) EPHX1ALDH1A1HTTEPHX2PPARA
SCHEMBL6711743 1.00 EPHX1 (0.62) EPHX1ALDH1A1HTTEPHX2PPARA
SCHEMBL1592801 1.00 EPHX1 (0.62) EPHX1ALDH1A1HTTEPHX2PPARA
SCHEMBL1592341 0.95 EPHX1 (0.54) EPHX1ALDH1A1HTTEPHX2PPARA
SCHEMBL8391695 0.86 EPHX1 (0.67) EPHX1ALDH1A1HTTEPHX2HDAC1
SCHEMBL10970233 0.82 BCL2L1 (0.61) PPARA
SCHEMBL11033138 0.81 EPHX1 (0.84) EPHX1ALDH1A1HTTEPHX2HDAC1
SCHEMBL11034317 0.81 EPHX1 (0.84) EPHX1ALDH1A1HTTEPHX2HDAC1
SCHEMBL6438783 0.81 EPHX1 (0.84) EPHX1ALDH1A1HTTEPHX2HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8283287-B2 Thermosensitive recording material RICOH COMPANY, LTD. (JP) 2012-10-09 US disclosed
EP-2036737-B1 Thermosensitive recording material RICOH CO LTD (JP) 2011-02-16 EP disclosed
US-20090075817-A1 THERMOSENSITIVE RECORDING MATERIAL RICOH COMPANY, LTD. (JP) 2009-03-19 US disclosed
EP-2036737-A1 Thermosensitive recording material Ricoh Company, Ltd. (JP) 2009-03-18 EP disclosed
US-4918047-A CONTAINING OXYSALICYLIC ACID DERIVATIVE AND ZINC COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1990-04-17 US disclosed
EP-0253666-A2 Heat-sensitive recording material containing dye-forming components FUJI PHOTO FILM CO., LTD. (JP) 1988-01-20 EP disclosed