SCHEMBL13699459

SCHEMBL13699459

O=C(/C=C\c1cc(CCO)cc(-n2nc3ccc(Cl)cc3n2)c1O)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.40
PTPN5 P54829 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
PKM P14618 1/20 0.39
MAOB P27338 2/20 0.39
TYR P14679 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
NPC1 O15118 1/20 0.36
NFKB1 P19838 1/20 0.36
RAB9A P51151 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
PTGS1 P23219 4/20 0.36
CYP1B1 Q16678 1/20 0.36
PTGS2 P35354 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
SCHEMBL13699493 0.92 TYR (0.40) PTPN5KDM4EALDH1A1LMNAPKM
SCHEMBL13700511 0.92 TYR (0.43) KDM4EALDH1A1LMNAPKMMAOB
SCHEMBL13700517 0.89 TYR (0.40) KDM4EALDH1A1LMNATYRMAPT
SCHEMBL13700519 0.88 NPC1 (0.39) KDM4EALDH1A1LMNATYRMAPT
SCHEMBL13700533 0.88 TYR (0.38) KDM4EALDH1A1LMNATYRMAPT
SCHEMBL13700516 0.86 CYP1A1 (0.40) MAOBTYRNPC1NFKB1RAB9A
SCHEMBL13699505 0.86 MAOB (0.43) ALDH1A1LMNAMAOBTYRMAPT
SCHEMBL13699363 0.86 ALDH1A1 (0.45) KDM4EALDH1A1LMNATYRMAPT
SCHEMBL13699489 0.86 TYR (0.37) KDM4EALDH1A1LMNAMAOBTYR
SCHEMBL13700535 0.85 MAPT (0.42) KDM4EALDH1A1LMNATYRMAPT

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 5 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-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
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