SCHEMBL4989931

SCHEMBL4989931

C1=NC=C(c2ccccc2)N(c2ccccc2)C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.37
RAB9A P51151 5/20 0.37
KDM4E B2RXH2 2/20 0.37
MAPT P10636 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
GLA P06280 1/20 0.37
MAPK1 P28482 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
SIGMAR1 Q99720 4/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
POLB P06746 1/20 0.34
PTAFR P25105 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
ABL1 P00519 1/20 0.30
EGFR P00533 1/20 0.30
CDK1 P06493 1/20 0.30
SRC P12931 1/20 0.30
KDR P35968 1/20 0.30
ABL2 P42684 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
SCHEMBL2697742 0.69 KDM4E (0.38) KDM4EMAPTSMN1; SMN2RPA1
SCHEMBL28060781 0.68 NPC1 (0.36) NPC1RAB9AKDM4EMAPTTDP1
SCHEMBL10687373 0.64 POLB (0.39) NPC1RAB9AKDM4EMAPTTDP1
SCHEMBL11514552 0.63 SIGMAR1 (0.35) NPC1RAB9AKDM4EMAPTTDP1
SCHEMBL663152 0.63 MAPT (0.35) NPC1RAB9AKDM4EMAPTTDP1
SCHEMBL11568355 0.63 MAPT (0.40) NPC1RAB9AKDM4EMAPTTDP1
SCHEMBL11748730 0.63 MEN1 (0.48) NPC1RAB9AKDM4EMAPTTDP1
SCHEMBL27913223 0.63 SIGMAR1 (0.43) NPC1RAB9AKDM4EMAPTTDP1
SCHEMBL29577177 0.62 NPC1 (0.38) NPC1RAB9AKDM4EMAPTTDP1
SCHEMBL11513917 0.62 NPC1 (0.38) NPC1RAB9AKDM4EMAPTTDP1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9425408-B2 Organic light emitting host materials NITTO DENKO CORPORATION (JP) 2016-08-23 US disclosed
US-9112159-B2 Bipolar hosts for light emitting devices NITTO DENKO CORPORATION (JP) 2015-08-18 US disclosed
US-20140284584-A1 ORGANIC LIGHT EMITTING BIPOLAR HOST MATERIALS NITTO DENKO CORPORATION (JP) 2014-09-25 US disclosed
US-20140284581-A1 ORGANIC LIGHT EMITTING HOST MATERIALS NITTO DENKO CORPORATION (JP) 2014-09-25 US disclosed
US-20140163237-A1 BIPOLAR HOSTS FOR LIGHT EMITTING DEVICES Nitto Denko Corportion (JP) 2014-06-12 US disclosed
US-20080139734-A1 Sealing Material Composition KANEKA CORPORATION (JP) 2008-06-12 US disclosed
EP-1743928-A1 SEALING MATERIAL COMPOSITION KANEKA CORPORATION (JP) 2007-01-17 EP disclosed
EP-0127375-A2 Toner for use in electrophotography TORAY INDUSTRIES, INC. (JP) 1984-12-05 EP disclosed