SCHEMBL8599536

SCHEMBL8599536

CCCCCCCCCCCCCCNC(=O)Nc1cccc(O)c1

nearest known ligand 0.75

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 9/20 0.75
ALDH1A1 P00352 1/20 0.71
HTT P42858 1/20 0.71
EPHX2 P34913 7/20 0.65
MARS1 P56192 1/20 0.58
MAPT P10636 1/20 0.57

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
SCHEMBL8599247 1.00 EPHX1 (0.75) EPHX1ALDH1A1HTTEPHX2MARS1
SCHEMBL8601252 1.00 EPHX1 (0.75) EPHX1ALDH1A1HTTEPHX2MARS1
SCHEMBL8598231 1.00 EPHX1 (0.75) EPHX1ALDH1A1HTTEPHX2MARS1
SCHEMBL3157400 1.00 EPHX1 (0.75) EPHX1ALDH1A1HTTEPHX2MARS1
SCHEMBL6064818 0.94 EPHX1 (0.66) EPHX1ALDH1A1HTTEPHX2MARS1
SCHEMBL6438910 0.91 EPHX1 (0.83) EPHX1ALDH1A1HTTEPHX2MAPT
SCHEMBL28516814 0.88 MAPT (0.72) EPHX1ALDH1A1HTTEPHX2MARS1
SCHEMBL12196036 0.86 EPHX1 (1.00) EPHX1ALDH1A1HTTEPHX2MAPT
SCHEMBL15975472 0.86 EPHX1 (0.75) EPHX1ALDH1A1HTTEPHX2MAPT
SCHEMBL12196058 0.86 EPHX1 (1.00) EPHX1ALDH1A1HTTEPHX2MAPT

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
EP-0709225-B1 Reversible multi-color thermal recording medium JUJO PAPER CO LTD (JP) 1998-08-05 EP disclosed
US-5710094-A HEAT RESISTANT ORGANIC UREA OR THIOUREA COLOR DEVELOPER NIPPON PAPER INDUSTRIES CO. LTD. (JP) 1998-01-20 US disclosed
EP-0709225-A1 Reversible multi-color thermal recording medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1996-05-01 EP disclosed