SCHEMBL4847348

SCHEMBL4847348

c1ccc2c(c1)c1ccc3c4cccc5c4cc4c3c1c1c2ccc2c3ccccc3c5c4c21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
HSD17B10 Q99714 5/20 0.48
CYP1A2 P05177 4/20 0.48
HPGD P15428 3/20 0.48
THRB P10828 1/20 0.48
ERBB2 P04626 1/20 0.43
FYN P06241 1/20 0.43
MAOA P21397 1/20 0.43
ACHE P22303 1/20 0.43
AHR P35869 1/20 0.43
HPRT1 P00492 4/20 0.39
HIF1A Q16665 2/20 0.38
TSHR P16473 2/20 0.38
MAPK1 P28482 1/20 0.38
CASP1 P29466 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TRPM4 Q8TD43 1/20 0.32
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
CYP1B1 Q16678 1/20 0.31

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
SCHEMBL5465711 0.92 HSD17B10 (0.43) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL5482727 0.91 HSD17B10 (0.55) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL5471422 0.89 ALDH1A1 (0.48) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL31177972 0.89 ALDH1A1 (0.48) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL5474056 0.89 ALDH1A1 (0.48) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL5470389 0.89 ALDH1A1 (0.48) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL5467001 0.89 ALDH1A1 (0.48) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL4845687 0.88 CYP1A2 (0.58) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL2533864 0.88 CYP1A2 (0.58) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL4846327 0.86 ALDH1A1 (0.50) ALDH1A1HSD17B10CYP1A2HPGDTHRB

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
WO-2005040303-A1 AGGREGATE ORGANIC LIGHT EMITTING DIODE DEVICES EASTMAN KODAK COMPANY (US) 2005-05-06 WO disclosed
US-20040076853-A1 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK COMPANY 2004-04-22 US disclosed