SCHEMBL4849356

SCHEMBL4849356

c1cc2c3c(c1)cc1c4ccccc4c4ccc5ccc6ccc-2c2c6c5c4c1c32

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.50
HSD17B10 Q99714 6/20 0.50
HPGD P15428 5/20 0.50
CYP1A2 P05177 4/20 0.50
ERBB2 P04626 1/20 0.50
FYN P06241 1/20 0.50
MAOA P21397 1/20 0.50
ACHE P22303 1/20 0.50
AHR P35869 1/20 0.50
THRB P10828 1/20 0.50
MAPK1 P28482 5/20 0.46
TSHR P16473 4/20 0.46
HIF1A Q16665 4/20 0.46
CASP1 P29466 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
CASP7 P55210 2/20 0.42
TP53 P04637 2/20 0.42
ATM Q13315 2/20 0.42
HPRT1 P00492 3/20 0.39
ANPEP P15144 1/20 0.38

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
SCHEMBL5470961 0.87 ALDH1A1 (0.67) ALDH1A1HSD17B10HPGDCYP1A2ERBB2
SCHEMBL4855691 0.87 ALDH1A1 (0.67) ALDH1A1HSD17B10HPGDCYP1A2ERBB2
SCHEMBL4852477 0.85 CYP1A2 (0.68) ALDH1A1HSD17B10HPGDCYP1A2ERBB2
SCHEMBL4850164 0.85 ALDH1A1 (0.56) ALDH1A1HSD17B10HPGDCYP1A2ERBB2
SCHEMBL5470432 0.85 ALDH1A1 (0.56) ALDH1A1HSD17B10HPGDCYP1A2ERBB2
SCHEMBL4852069 0.83 ALDH1A1 (0.67) ALDH1A1HSD17B10HPGDCYP1A2ERBB2
SCHEMBL4846773 0.83 CYP1A2 (0.70) ALDH1A1HSD17B10HPGDCYP1A2ERBB2
SCHEMBL4851924 0.83 ALDH1A1 (0.67) ALDH1A1HSD17B10HPGDCYP1A2ERBB2
SCHEMBL4849479 0.83 CYP1A2 (0.63) ALDH1A1HSD17B10HPGDCYP1A2ERBB2
SCHEMBL5466363 0.83 CYP1A2 (0.63) ALDH1A1HSD17B10HPGDCYP1A2ERBB2

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-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-7175922-B2 Aggregate organic light emitting diode devices with improved operational stability EASTMAN KODAK COMPANY (US) 2007-02-13 US disclosed
US-20050245428-A1 Hydroscopic polymer gels for easier cleaning RODRIGUES KLIN A 2005-11-03 US disclosed
US-20050106415-A1 Aggregate organic light emitting diode devices with improved operational stability EASTMAN KODAK COMPANY 2005-05-19 US disclosed
US-20040076853-A1 Organic light-emitting diode devices with improved operational stability EASTMAN KODAK COMPANY 2004-04-22 US disclosed