SCHEMBL4846883

SCHEMBL4846883

c1ccc2c(c1)ccc1c2ccc2c3ccccc3c3c4ccccc4ccc3c12

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 4/20 0.74
HSD17B10 Q99714 4/20 0.63
ALDH1A1 P00352 4/20 0.63
TDP1 Q9NUW8 3/20 0.63
TSHR P16473 2/20 0.63
CYP2A6 P11509 1/20 0.63
CYP1A2 P05177 3/20 0.59
HPGD P15428 3/20 0.59
THRB P10828 1/20 0.59
HIF1A Q16665 3/20 0.52
CYP1B1 Q16678 1/20 0.52
PAX8 Q06710 1/20 0.52
MAPK1 P28482 3/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
CYP3A4 P08684 2/20 0.52
ERBB2 P04626 1/20 0.52
FYN P06241 1/20 0.52
MAOA P21397 1/20 0.52
ACHE P22303 1/20 0.52
AHR P35869 1/20 0.52

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
SCHEMBL4851732 1.00 HPRT1 (0.74) HPRT1HSD17B10ALDH1A1TDP1TSHR
SCHEMBL2537946 0.97 HPRT1 (0.68) HPRT1HSD17B10ALDH1A1TDP1TSHR
SCHEMBL4851786 0.97 HPRT1 (0.78) HPRT1HSD17B10ALDH1A1TDP1TSHR
SCHEMBL30424788 0.97 HPRT1 (0.68) HPRT1HSD17B10ALDH1A1TDP1TSHR
SCHEMBL4851944 0.95 HPRT1 (0.65) HPRT1HSD17B10ALDH1A1TDP1TSHR
SCHEMBL297902 0.95 HPRT1 (0.72) HPRT1HSD17B10ALDH1A1TDP1TSHR
SCHEMBL29402390 0.95 HPRT1 (0.72) HPRT1HSD17B10ALDH1A1TDP1TSHR
SCHEMBL30583321 0.95 HPRT1 (0.72) HPRT1HSD17B10ALDH1A1TDP1TSHR
SCHEMBL30892665 0.95 HPRT1 (0.72) HPRT1HSD17B10ALDH1A1TDP1TSHR
SCHEMBL3701854 0.95 HPRT1 (0.82) HPRT1HSD17B10ALDH1A1TDP1TSHR

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