SCHEMBL8623969

SCHEMBL8623969

CCCCCCCCCCNC(=O)NCCCCCCSc1ccc(O)cc1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.57
EPHX2 P34913 3/20 0.57
EPHX1 P07099 9/20 0.54
HPGD P15428 1/20 0.50
PLK1 P53350 3/20 0.48
THRA P10827 1/20 0.48
THRB P10828 1/20 0.48
NAAA Q02083 1/20 0.48
ALDH1A1 P00352 1/20 0.48
HTT P42858 1/20 0.48

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
SCHEMBL8390581 1.00 CNR2 (0.57) CNR2EPHX2EPHX1HPGDPLK1
SCHEMBL8391587 0.97 EPHX1 (0.54) CNR2EPHX2EPHX1HPGDPLK1
SCHEMBL8388750 0.94 EPHX1 (0.54) CNR2EPHX2EPHX1HPGDNAAA
SCHEMBL8388519 0.94 EPHX1 (0.54) CNR2EPHX2EPHX1HPGDNAAA
SCHEMBL8389664 0.91 HPGD (0.50) CNR2EPHX2EPHX1HPGDPLK1
SCHEMBL8389466 0.89 HPGD (0.50) CNR2EPHX2EPHX1HPGDPLK1
SCHEMBL8627001 0.89 EPHX1 (0.54) CNR2EPHX2EPHX1HPGDNAAA
SCHEMBL8391685 0.89 EPHX1 (0.54) CNR2EPHX2EPHX1HPGDNAAA
SCHEMBL8623426 0.88 HPGD (0.60) CNR2HPGDTHRATHRBNAAA
SCHEMBL8622105 0.88 HPGD (0.47) CNR2EPHX2EPHX1HPGDNAAA

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-0648612-B1 Reversible heat-sensitive recording material MITSUBISHI PAPER MILLS LTD (JP) 1998-06-10 EP disclosed
US-5498772-A SUBSTRATE WITH HEAT SENSITIVE LAYER AND OPTICAL RECORDING LAYER MITSUBISHI PAPER MILLS LIMITED (JP) 1996-03-12 US disclosed
EP-0648612-A1 Reversible heat-sensitive recording material MITSUBISHI PAPER MILLS, LTD. (JP) 1995-04-19 EP disclosed