SCHEMBL4852483

SCHEMBL4852483

c1ccc2cc3c(cc2c1)Cc1ccc2c(ccc4ccccc42)c1-3

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 4/20 0.48
ALDH1A1 P00352 4/20 0.44
CYP1A2 P05177 4/20 0.44
HIF1A Q16665 3/20 0.44
MAPK1 P28482 3/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
LMNA P02545 2/20 0.44
HPGD P15428 2/20 0.44
MEN1 O00255 1/20 0.44
USP2 O75604 1/20 0.44
TP53 P04637 1/20 0.44
CYP2D6 P10635 1/20 0.44
ALOX12 P18054 1/20 0.44
KMT2A Q03164 1/20 0.44
HSD17B10 Q99714 3/20 0.41
TSHR P16473 2/20 0.41
CYP2A6 P11509 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
SOS1 Q07889 1/20 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
SCHEMBL4855064 0.91 MAPT (0.41) HPRT1ALDH1A1HIF1AMAPK1CYP2C9
SCHEMBL4847777 0.84 HPRT1 (0.50) HPRT1ALDH1A1CYP1A2HIF1AMAPK1
SCHEMBL4854059 0.83 TSHR (0.39) HPRT1ALDH1A1CYP1A2HIF1AMAPK1
SCHEMBL14452865 0.79 CLK1 (0.43) ALDH1A1HPGDMAPT
SCHEMBL14452842 0.79 CLK1 (0.43) ALDH1A1HPGDMAPT
SCHEMBL27346263 0.75 HPRT1 (0.52) HPRT1ALDH1A1CYP1A2HIF1AMAPK1
SCHEMBL868639 0.75 TSHR (0.52) HPRT1ALDH1A1CYP1A2HIF1AHSD17B10
SCHEMBL29716676 0.75 TSHR (0.52) HPRT1ALDH1A1CYP1A2HIF1AHSD17B10
SCHEMBL1655232 0.74 MEN1 (0.46) ALDH1A1CYP1A2HIF1AMAPK1CYP2C9
SCHEMBL30924248 0.74 MEN1 (0.46) ALDH1A1CYP1A2HIF1AMAPK1CYP2C9

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