SCHEMBL9229488

SCHEMBL9229488

O=C=Nc1cccc2cc3c(N=C=O)cccc3cc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 0.54
ALDH1A1 P00352 6/20 0.44
HPGD P15428 4/20 0.44
HSD17B10 Q99714 4/20 0.44
CYP1A2 P05177 4/20 0.44
TDP1 Q9NUW8 3/20 0.44
MAOA P21397 2/20 0.44
ABCB11 O95342 1/20 0.44
NR3C1 P04150 1/20 0.44
ADRA2A P08913 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
ALOX15 P16050 1/20 0.44
ADRA2C P18825 1/20 0.44
DRD1 P21728 1/20 0.44
SLC6A4 P31645 1/20 0.44
HTR2B P41595 1/20 0.44
CCR2 P41597 1/20 0.44
TRPA1 O75762 1/20 0.38
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36

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
SCHEMBL3714186 0.94 CYP3A4 (0.48) CYP3A4ALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL6858063 0.84 CYP1A2 (0.43) CYP3A4ALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL29642695 0.83 CYP3A4 (0.49) CYP3A4ALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL29642626 0.83 CYP3A4 (0.49) CYP3A4ALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL29642545 0.83 CYP3A4 (0.49) CYP3A4ALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL662710 0.83 CYP3A4 (0.49) CYP3A4ALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL543165 0.83 CYP3A4 (0.49) CYP3A4ALDH1A1HPGDHSD17B10CYP1A2
Alpha-Naphthylisocyanate SCHEMBL374 0.83 CYP1A2 (0.64) CYP3A4ALDH1A1HPGDHSD17B10CYP1A2
Alpha-Naphthylisocyanate SCHEMBL29400034 0.83 CYP1A2 (0.64) CYP3A4ALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL1169526 0.83 CYP3A4 (0.43) CYP3A4ALDH1A1HPGDHSD17B10CYP1A2

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-8847075-B2 Insulated wire FURUKAWA ELECTRIC CO., LTD. (JP) 2014-09-30 US disclosed
US-20130037304-A1 INSULATED WIRE ESSEX FURUKAWA MAGNET WIRE JAPAN CO., LTD. (JP) 2013-02-14 US disclosed
US-5393612-A Conductor and insulating coating having tensile strength of at least 13 kg/mm2 SUMITOMO ELECTRIC INDUSTRIES, LTD. (JP) 1995-02-28 US disclosed