SCHEMBL13699493

SCHEMBL13699493

O=C(/C=C\c1cc(CCO)cc(-n2nc3cc(Cl)c(Cl)cc3n2)c1O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.40
MAPT P10636 3/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
HSP90AA1 P07900 1/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
PTGS1 P23219 3/20 0.38
HPGD P15428 3/20 0.36
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 2/20 0.36
LMNA P02545 2/20 0.36
PTPN5 P54829 1/20 0.36
PKM P14618 1/20 0.36
MAPK1 P28482 1/20 0.36
MAOB P27338 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
SCHEMBL13699459 0.92 GRM5 (0.40) TYRMAPTNPC1RAB9ANFKB1
SCHEMBL13700511 0.92 TYR (0.43) TYRMAPTKMT2ANPC1RAB9A
SCHEMBL13700517 0.89 TYR (0.40) TYRMAPTKMT2AMEN1NPC1
SCHEMBL13700519 0.87 NPC1 (0.39) TYRMAPTKMT2AMEN1NPC1
SCHEMBL13700533 0.87 TYR (0.38) TYRMAPTKMT2AMEN1NPC1
SCHEMBL13699505 0.86 MAOB (0.43) TYRMAPTKMT2AMEN1NPC1
SCHEMBL13699489 0.86 TYR (0.37) TYRMAPTKMT2AMEN1NPC1
SCHEMBL13699363 0.86 ALDH1A1 (0.45) TYRMAPTNPC1RAB9ANFKB1
SCHEMBL13700516 0.86 CYP1A1 (0.40) TYRNPC1RAB9ANFKB1NFKB2
SCHEMBL13700535 0.85 MAPT (0.42) TYRMAPTKMT2AMEN1NPC1

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
US-8324399-B2 Heat resistance improver and reversible thermosensitive recording medium RICOH COMPANY, LTD. (JP) 2012-12-04 US disclosed
US-20090239747-A1 HEAT RESISTANCE IMPROVER AND REVERSIBLE THERMOSENSITIVE RECORDING MEDIUM RICOH COMPANY, LTD. (JP) 2009-09-24 US disclosed
EP-2103445-A1 Heat resistance improver and reversible thermosensitive recording medium Ricoh Company, Ltd. (JP) 2009-09-23 EP disclosed