SCHEMBL14979357

SCHEMBL14979357

c1ccc(-c2ccc(-c3ccc(-c4cnc(-n5c6ccccc6c6ccc7ccccc7c65)nc4)cc3)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
RECQL P46063 1/20 0.37
KDM4E B2RXH2 3/20 0.35
NFKB1 P19838 2/20 0.35
NFKB2 Q00653 2/20 0.35
RELA Q04206 2/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MAPK10 P53779 1/20 0.33
CHRNA7 P36544 1/20 0.32
KCNH2 Q12809 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
IDO1 P14902 1/20 0.32
FGFR1 P11362 1/20 0.32
HPRT1 P00492 1/20 0.32
PSEN1 P49768 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
SCHEMBL14979397 0.96 NPC1 (0.35) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL14979401 0.96 NPC1 (0.35) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL14979313 0.95 TNF (0.35) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL14979394 0.95 TNF (0.35) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL14979314 0.95 FGFR1 (0.35) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL14979358 0.93 NPC1 (0.35) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL14979316 0.92 TNF (0.35) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL14979359 0.91 NPC1 (0.33) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL14979415 0.91 MAPK10 (0.33) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL14979391 0.91 MAPK10 (0.33) NPC1RAB9ASMN1; SMN2LMNAMAPT

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-20140316136-A1 NOVEL ORGANIC ELECTROLUMINESCENCE COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING SAME ROHM & HAAS ELECT MAT (KR) 2014-10-23 US disclosed
US-20140316136-A1 NOVEL ORGANIC ELECTROLUMINESCENCE COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING SAME ROHM & HAAS ELECT MAT (KR) 2014-10-23 US disclosed
WO-2013073859-A1 NOVEL ORGANIC ELECTROLUMINESCENCE COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2013-05-23 WO disclosed