SCHEMBL4316684

SCHEMBL4316684

c1ccc(N(c2ccccc2)c2ccc(-c3ccc(N(c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)c4ccc5c6cccc7cccc(c8cccc4c85)c76)s3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.41
MAPT P10636 1/20 0.34
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
THRB P10828 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL4310908 0.91 CYP1A1 (0.35) ALDH1A1CYP1A2THRBHPGDHSD17B10
SCHEMBL14506047 0.85 APP (0.39) APPMAPTALDH1A1CYP1A2THRB
SCHEMBL13899996 0.82 CYP1A2 (0.38) APPMAPTALDH1A1CYP1A2THRB
SCHEMBL25028184 0.81 CYP1A2 (0.37) APPMAPTALDH1A1CYP1A2THRB
SCHEMBL13899997 0.81 ALDH1A1 (0.42) MAPTALDH1A1CYP1A2THRBHPGD
SCHEMBL25027989 0.81 CA12 (0.34) ALDH1A1CYP1A2THRBHPGDHSD17B10
SCHEMBL8994843 0.80 CYP1A2 (0.36) APPALDH1A1CYP1A2THRBHPGD
SCHEMBL13084730 0.80 CYP1A2 (0.38) ALDH1A1CYP1A2THRBHPGDHSD17B10
SCHEMBL4026976 0.79 ALDH1A1 (0.43) MAPTALDH1A1CYP1A2THRBHPGD
SCHEMBL2329233 0.79 RXRA (0.36) ALDH1A1CYP1A2THRBHPGDHSD17B10

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-7504163-B2 Hole-trapping materials for improved OLED efficiency EASTMAN KODAK COMPANY (US) 2009-03-17 US disclosed
US-20070126347-A1 OLEDS with improved efficiency EASTMAN KODAK COMPANY 2007-06-07 US disclosed
US-20060008672-A1 Hole-trapping materials for improved OLED efficiency EASTMAN KODAK COMPANY 2006-01-12 US disclosed