SCHEMBL13700413

SCHEMBL13700413

Cc1cc(CO)cc(-n2nc3ccc(C(F)(F)F)cc3n2)c1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.38
KDM4E B2RXH2 2/20 0.37
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
RIPK2 O43353 1/20 0.34
KDR P35968 1/20 0.34
MAPK14 Q16539 1/20 0.34
POLB P06746 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.32
MC4R P32245 1/20 0.31
IDH1 O75874 1/20 0.31
AKR1B1 P15121 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MEN1 O00255 1/20 0.31
HSP90AA1 P07900 1/20 0.31
MAPT P10636 1/20 0.31
CRHBP P24387 1/20 0.31
KMT2A Q03164 1/20 0.31
CRHR2 Q13324 1/20 0.31

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
SCHEMBL13699378 0.91 PKM (0.36) PKMKDM4ENPC1RAB9ARIPK2
SCHEMBL30240951 0.82 NPC1 (0.52) KDM4ENPC1RAB9APOLBLMNA
SCHEMBL74503 0.82 NPC1 (0.52) KDM4ENPC1RAB9APOLBLMNA
SCHEMBL13700387 0.81 NPC1 (0.40) PKMKDM4ENPC1RAB9ALMNA
SCHEMBL1100991 0.81 NPC1 (0.44) PKMKDM4ENPC1RAB9ARIPK2
SCHEMBL2637886 0.77 ALDH1A1 (0.35) PKMKDM4ENPC1RAB9APOLB
SCHEMBL13700724 0.76 KDM4E (0.35) PKMKDM4EPOLB
SCHEMBL13700441 0.76 KDM4E (0.33) PKMKDM4ENPC1RAB9APOLB
SCHEMBL1100542 0.75 CACNA1D (0.38) PKMKDM4EMC4RMEN1KMT2A
SCHEMBL2639325 0.75 ALDH1A1 (0.34) PKMKDM4ENPC1RAB9APOLB

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 4 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