SCHEMBL14416397

SCHEMBL14416397

c1ccc(-c2ccc3c(c2)c2cc(-c4ccc5ccccc5c4)ccc2n3-c2ccc(-c3ccc(-c4cc(-c5ccccc5)nc(-c5ccccc5)n4)cc3)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 1/20 0.48
CYP1B1 Q16678 1/20 0.48
MEN1 O00255 6/20 0.44
KMT2A Q03164 6/20 0.44
ALDH1A1 P00352 5/20 0.44
MAPT P10636 4/20 0.44
HPGD P15428 4/20 0.44
NTSR1 P30989 1/20 0.44
PIK3CD O00329 1/20 0.41
PIK3CA P42336 1/20 0.41
MTOR P42345 1/20 0.41
KDM4E B2RXH2 3/20 0.40
CYP1A2 P05177 3/20 0.40
TP53 P04637 2/20 0.40
HSD17B10 Q99714 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
LMNA P02545 1/20 0.40
GLA P06280 1/20 0.40
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39

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
SCHEMBL14416394 1.00 CYP1A1 (0.48) CYP1A1CYP1B1MEN1KMT2AALDH1A1
SCHEMBL14416396 0.96 CYP1A1 (0.45) CYP1A1CYP1B1MEN1KMT2AALDH1A1
SCHEMBL15197810 0.94 CYP1A1 (0.46) CYP1A1CYP1B1MEN1KMT2AALDH1A1
SCHEMBL14416390 0.93 MEN1 (0.50) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL22763792 0.93 MEN1 (0.50) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL19928015 0.93 MEN1 (0.50) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL22763391 0.93 MEN1 (0.50) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL22763788 0.93 MEN1 (0.50) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL22763405 0.93 MEN1 (0.50) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL22763410 0.93 MEN1 (0.50) MEN1KMT2AALDH1A1MAPTHPGD

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-9523031-B2 Organic electroluminescent device IDEMITSU KOSAN CO., LTD. (JP) 2016-12-20 US disclosed
US-9523031-B2 Organic electroluminescent device IDEMITSU KOSAN CO., LTD. (JP) 2016-12-20 US disclosed
US-20070224448-A1 Organic Electroluminescent Device IDEMITSU KOSAN CO., LTD. (JP) 2007-09-27 US disclosed
US-20070224448-A1 Organic Electroluminescent Device IDEMITSU KOSAN CO., LTD. (JP) 2007-09-27 US disclosed