SCHEMBL15034647

SCHEMBL15034647

c1ccc2c(-c3ccc4c5ccccc5c5ccccc5c4c3)nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)sc5ccccc56)ccc43)nc2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.37
ALDH1A1 P00352 4/20 0.37
KDM4E B2RXH2 3/20 0.37
MAPT P10636 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
L3MBTL1 Q9Y468 3/20 0.36
LMNA P02545 2/20 0.35
POLB P06746 1/20 0.34
MAPK1 P28482 1/20 0.34
ATM Q13315 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 1/20 0.32
TP53 P04637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
NPY5R Q15761 1/20 0.31
SCN9A Q15858 2/20 0.30
GPR3 P46089 1/20 0.30
PTGER4 P35408 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
SCHEMBL15682482 0.94 ALDH1A1 (0.43) HPGDALDH1A1KDM4EMAPTNPSR1
SCHEMBL24596459 0.94 L3MBTL1 (0.38) HPGDALDH1A1KDM4EMAPTNPSR1
SCHEMBL15682506 0.94 ALDH1A1 (0.42) HPGDALDH1A1KDM4EMAPTNPSR1
SCHEMBL15682492 0.93 HPGD (0.35) HPGDALDH1A1KDM4EMAPTNPSR1
SCHEMBL15682527 0.92 HPGD (0.38) HPGDALDH1A1KDM4EMAPTNPSR1
SCHEMBL24596518 0.90 HPGD (0.36) HPGDALDH1A1KDM4EMAPTNPSR1
SCHEMBL21213366 0.89 HPGD (0.37) HPGDALDH1A1KDM4EMAPTNPSR1
SCHEMBL16475746 0.89 ALDH1A1 (0.44) HPGDALDH1A1KDM4EMAPTNPSR1
SCHEMBL15682548 0.89 ALDH1A1 (0.34) HPGDALDH1A1KDM4EMAPTNPSR1
SCHEMBL24036839 0.89 HPGD (0.42) HPGDALDH1A1KDM4EMAPTNPSR1

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-20140336392-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM & HAAS ELECT MAT (KR) 2014-11-13 US disclosed
US-20140336392-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM & HAAS ELECT MAT (KR) 2014-11-13 US disclosed
WO-2013085243-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2013-06-13 WO disclosed