SCHEMBL8627331

SCHEMBL8627331

CCCCCCCCCCCCCCOC(=O)NCNC(=O)c1ccc(O)cc1O

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.51
HTT P42858 1/20 0.49
KDM4E B2RXH2 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 2/20 0.46
HPGD P15428 2/20 0.46
ALDH1A1 P00352 2/20 0.46
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
CA14 Q9ULX7 1/20 0.45
ACHE P22303 6/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
GFER P55789 1/20 0.44
SERPINE1 P05121 1/20 0.43

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
SCHEMBL8391516 1.00 NAAA (0.51) NAAAHTTKDM4ESMN1; SMN2LMNA
SCHEMBL8622102 1.00 NAAA (0.51) NAAAHTTKDM4ESMN1; SMN2LMNA
SCHEMBL8622139 1.00 NAAA (0.51) NAAAHTTKDM4ESMN1; SMN2LMNA
SCHEMBL8624857 0.86 HTT (0.52) NAAAHTTKDM4ESMN1; SMN2LMNA
SCHEMBL8624344 0.86 HTT (0.52) NAAAHTTKDM4ESMN1; SMN2LMNA
SCHEMBL8391457 0.86 HTT (0.52) NAAAHTTKDM4ESMN1; SMN2LMNA
SCHEMBL8388607 0.86 HTT (0.52) NAAAHTTKDM4ESMN1; SMN2LMNA
SCHEMBL8623610 0.82 SMN1; SMN2 (0.52) SMN1; SMN2LMNAACHENPC1RAB9A
SCHEMBL8391807 0.82 SMN1; SMN2 (0.52) SMN1; SMN2LMNAACHENPC1RAB9A
SCHEMBL8621112 0.82 SMN1; SMN2 (0.52) SMN1; SMN2LMNAACHENPC1RAB9A

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