SCHEMBL14979397

SCHEMBL14979397

c1ccc(-c2ccc(-c3cc(-c4ccccc4)cc(-c4cnc(-n5c6ccccc6c6ccc7ccccc7c65)nc4)c3)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
RECQL P46063 1/20 0.35
MAPK10 P53779 1/20 0.34
FGFR1 P11362 1/20 0.33
KDM4E B2RXH2 2/20 0.33
NFKB1 P19838 2/20 0.33
NFKB2 Q00653 2/20 0.33
RELA Q04206 2/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PSEN1 P49768 1/20 0.32
PSEN2 P49810 1/20 0.32
APH1B Q8WW43 1/20 0.32
NCSTN Q92542 1/20 0.32
APH1A Q96BI3 1/20 0.32
PSENEN Q9NZ42 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
SCHEMBL14979401 1.00 NPC1 (0.35) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL14979314 0.96 FGFR1 (0.35) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL14979357 0.96 NPC1 (0.37) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL14979358 0.95 NPC1 (0.35) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL14979434 0.94 CTDSP1 (0.37) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL17990550 0.93 L3MBTL1 (0.39) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL14979403 0.91 PDGFRB (0.39) MAPTMAPK10KDM4E
SCHEMBL14979313 0.91 TNF (0.35) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL14979394 0.91 TNF (0.35) NPC1RAB9ASMN1; SMN2LMNAMAPT
SCHEMBL14979347 0.90 MAPK10 (0.35) 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