SCHEMBL13699469

SCHEMBL13699469

Cc1cc(CCO)cc(-n2nc3ccc(C#N)cc3n2)c1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49
HPGD P15428 2/20 0.49
POLB P06746 2/20 0.49
ALOX15 P16050 1/20 0.49
MAPK1 P28482 1/20 0.49
HSD17B10 Q99714 1/20 0.49
LMNA P02545 2/20 0.35
TP53 P04637 1/20 0.35
THRB P10828 1/20 0.35
MAPT P10636 1/20 0.35
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
TTK P33981 1/20 0.31
BRD4 O60885 1/20 0.31
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31
FFAR1 O14842 1/20 0.31
PKMYT1 Q99640 1/20 0.30
IDH1 O75874 1/20 0.30

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
SCHEMBL13699500 0.84 KDM4E (0.47) KDM4EALDH1A1HPGDPOLBALOX15
SCHEMBL30240966 0.82 NPC1 (0.50) KDM4EALDH1A1HPGDPOLBALOX15
SCHEMBL74479 0.82 NPC1 (0.50) KDM4EALDH1A1HPGDPOLBALOX15
SCHEMBL13700406 0.82 MAPT (0.39) KDM4EALDH1A1HPGDPOLBALOX15
SCHEMBL13700429 0.82 NPC1 (0.42) KDM4EALDH1A1HPGDPOLBALOX15
SCHEMBL13699378 0.79 PKM (0.36) KDM4EALDH1A1HPGDPOLBALOX15
SCHEMBL13699440 0.79 ALDH1A1 (0.39) KDM4EALDH1A1HPGDPOLBALOX15
SCHEMBL13699427 0.79 KDM4E (0.35) KDM4EALDH1A1HPGDPOLBALOX15
SCHEMBL13700402 0.79 NPC1 (0.43) KDM4EALDH1A1HPGDPOLBALOX15
SCHEMBL13699452 0.78 PTGS2 (0.37) KDM4EALDH1A1HPGDPOLBALOX15

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