SCHEMBL8637586

SCHEMBL8637586

CC(C)c1c(-c2ccc(N)cc2)cccc1-c1ccc(N)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
ALDH1A1 P00352 2/20 0.42
TP53 P04637 1/20 0.42
TAAR1 Q96RJ0 3/20 0.41
HSD17B10 Q99714 2/20 0.41
KIT P10721 2/20 0.41
KDR P35968 2/20 0.41
FLT3 P36888 2/20 0.41
APP P05067 2/20 0.38
USP7 Q93009 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
NCOA1 Q15788 1/20 0.36
NCOA3 Q9Y6Q9 1/20 0.36
PRKCZ Q05513 1/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL7671735 0.88 CA1 (0.44) CYP3A4TDP1ALDH1A1TP53TAAR1
SCHEMBL12446718 0.84 GRIA4 (0.35) CYP3A4TDP1ALDH1A1TP53TAAR1
SCHEMBL28423706 0.79 CDC25A (0.44) ALDH1A1HSD17B10MAPTKMT2A
SCHEMBL28057567 0.79 ALDH1A1 (0.39) CYP3A4TDP1ALDH1A1TP53TAAR1
Methane SCHEMBL28536983 0.78 CYP3A4 (0.37) CYP3A4TDP1ALDH1A1TP53TAAR1
SCHEMBL2787589 0.77 CA1 (0.61) CYP3A4TDP1ALDH1A1TP53TAAR1
SCHEMBL30808560 0.76 CA1 (0.44) CYP3A4TDP1ALDH1A1TP53TAAR1
SCHEMBL28977901 0.76 CA1 (0.44) CYP3A4TDP1ALDH1A1TP53TAAR1
SCHEMBL3689994 0.76 CA1 (0.46) CYP3A4CA12CA1CA2CA9
SCHEMBL1876622 0.75 USP7 (0.43) CYP3A4TDP1ALDH1A1TP53TAAR1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5723571-A POLYIMIDESILOXANE COPOLYMERS TOMOEGAWA PAPER CO., LTD. (JP) 1998-03-03 US disclosed
US-5705144-A SKIN LIGHTENING COMPOSITION AND RADIATION RESISTANCE UNILEVER PATENT HOLDINGS B.V. (NL) 1998-01-06 US disclosed
US-5545399-A MIXTURE OF HYDROCHALCONE DERIVATIVE AND RETINOL OR DERIVATIVE THEREOF CHESEBROUGH-POND'S USA CO. (US) 1996-08-13 US disclosed
US-5215749-A Sunscreen of titanium dioxide and octyl methoxycinnamate in vehicle CHESEBROUGH-POND'S USA CO., DIVISION OF CONOPCO, INC. (US) 1993-06-01 US disclosed
US-5196187-A Water-in-silicone oil emulsion CHESEBROUGH-POND'S USA CO., DIVISION OF CONOPCO, INC. (US) 1993-03-23 US disclosed
US-5152983-A Mixture of 1,3-propanedione, 1-(4-methoxy-5-benzofurnyl)-3-phenyl and a carrier for topical application to human skin or hair CHESEBROUGH-POND'S USA CO., DIVISION OF CONOPCO, INC. (US) 1992-10-06 US disclosed