SCHEMBL4846292

SCHEMBL4846292

c1cc2c3c(cccc3c1)-c1c-2ccc2ccc3ccccc3c12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.54
HSD17B10 Q99714 7/20 0.54
TSHR P16473 6/20 0.54
MAPK1 P28482 6/20 0.54
L3MBTL1 Q9Y468 3/20 0.54
ATM Q13315 3/20 0.54
DNMT1 P26358 2/20 0.48
HPGD P15428 6/20 0.48
CASP1 P29466 4/20 0.48
HIF1A Q16665 4/20 0.48
CASP7 P55210 3/20 0.48
TP53 P04637 2/20 0.48
CYP1A2 P05177 4/20 0.46
THRB P10828 1/20 0.46
ANPEP P15144 1/20 0.44
CYP3A4 P08684 3/20 0.44
PABPC1 P11940 1/20 0.44
CYP2A6 P11509 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CES1 P23141 2/20 0.41

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
Benzo(J)Fluoranthene SCHEMBL69111 0.90 ALDH1A1 (0.56) ALDH1A1HSD17B10TSHRMAPK1L3MBTL1
Benzo(J)Fluoranthene SCHEMBL28871006 0.88 ALDH1A1 (0.54) ALDH1A1HSD17B10TSHRMAPK1L3MBTL1
SCHEMBL2484789 0.85 HPRT1 (0.52) ALDH1A1HSD17B10TSHRMAPK1L3MBTL1
SCHEMBL30046632 0.85 HPRT1 (0.52) ALDH1A1HSD17B10TSHRMAPK1L3MBTL1
SCHEMBL2534907 0.84 ALDH1A1 (0.54) ALDH1A1HSD17B10TSHRMAPK1L3MBTL1
SCHEMBL25412675 0.83 ALDH1A1 (0.62) ALDH1A1HSD17B10TSHRMAPK1L3MBTL1
SCHEMBL31171149 0.83 ALDH1A1 (0.62) ALDH1A1HSD17B10TSHRMAPK1L3MBTL1
SCHEMBL31275801 0.82 ALDH1A1 (0.52) ALDH1A1HSD17B10TSHRMAPK1L3MBTL1
SCHEMBL25403482 0.82 ALDH1A1 (0.52) ALDH1A1HSD17B10TSHRMAPK1L3MBTL1
SCHEMBL2958546 0.82 ALDH1A1 (0.52) ALDH1A1HSD17B10TSHRMAPK1L3MBTL1

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-7470290-B2 Hydroscopic polymer gels for easier cleaning THE CLOROX COMPANY (US) 2008-12-30 US disclosed
US-7183010-B2 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK CORPORATION (US) 2007-02-27 US disclosed
US-20050245428-A1 Hydroscopic polymer gels for easier cleaning RODRIGUES KLIN A 2005-11-03 US disclosed
US-20040076853-A1 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK COMPANY 2004-04-22 US disclosed