SCHEMBL4855159

SCHEMBL4855159

C1=Cc2c(ccc3c4ccccc4c4ccccc4c23)C1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
THRB P10828 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
HPRT1 P00492 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 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
SCHEMBL4623032 0.79 HSD17B10 (0.39) ALDH1A1CYP1A2THRBHPGDHSD17B10
SCHEMBL30516909 0.79 HPRT1 (0.52) ALDH1A1CYP1A2THRBHPGDHSD17B10
SCHEMBL1445153 0.79 HPRT1 (0.52) ALDH1A1CYP1A2THRBHPGDHSD17B10
SCHEMBL29442976 0.75 ALDH1A1 (0.44) ALDH1A1CYP1A2THRBHPGDHSD17B10
SCHEMBL4623560 0.75 ALDH1A1 (0.44) ALDH1A1CYP1A2THRBHPGDHSD17B10
Lithium SCHEMBL29767624 0.73 ALDH1A1 (0.42) ALDH1A1CYP1A2THRBHPGDHSD17B10
SCHEMBL30516914 0.70 HPRT1 (0.36) ALDH1A1CYP1A2HPGDHSD17B10HPRT1
SCHEMBL6643583 0.70 CYP1A2 (0.37) CYP1A2CA1CA2
SCHEMBL4403298 0.67 MEN1 (0.34) THRB
SCHEMBL302728 0.67

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