SCHEMBL13699455

SCHEMBL13699455

CCOOCc1ccc2nn(-c3cc(CCO)cc(C#N)c3O)nc2c1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
POLB P06746 1/20 0.44
ALOX15 P16050 1/20 0.44
MAPK1 P28482 1/20 0.44
HSD17B10 Q99714 1/20 0.44
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL13700706 0.91 KDM4E (0.45) KDM4EALDH1A1HPGDPOLBALOX15
SCHEMBL13700495 0.87 ALDH1A1 (0.43) KDM4EALDH1A1HPGDPOLBALOX15
SCHEMBL13699394 0.85 KDM4E (0.38) KDM4EALDH1A1HPGDPOLBALOX15
SCHEMBL13700499 0.81 HSD17B10 (0.41) KDM4EALDH1A1HPGDPOLBALOX15
SCHEMBL13700488 0.80 KDM4E (0.54) KDM4EALDH1A1HPGDPOLBALOX15
SCHEMBL13699467 0.80 KDM4E (0.42) KDM4EALDH1A1HPGDPOLBALOX15
SCHEMBL13700492 0.78 MEN1 (0.47) KDM4EALDH1A1HPGDPOLBALOX15
SCHEMBL13700502 0.78 CYP4A11 (0.41) KDM4EALDH1A1HPGDPOLBALOX15
SCHEMBL14137964 0.78 KDM4E (0.36) KDM4EALDH1A1HPGDPOLBALOX15
SCHEMBL13699510 0.77 KDM4E (0.40) 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