SCHEMBL878974

SCHEMBL878974

OCNCc1ccccc1O

nearest known ligand 0.78

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.78
▸ CYP2D6 P10635 1/20 0.78
▸ HIF1A Q16665 1/20 0.78
▸ CA12 O43570 6/20 0.72
▸ CA2 P00918 6/20 0.72
▸ CA9 Q16790 5/20 0.67
▸ KDM4E B2RXH2 1/20 0.67
▸ HSD17B10 Q99714 1/20 0.67
▸ MPO P05164 8/20 0.64
▸ PKM P14618 1/20 0.62
▸ SLC6A4 P31645 1/20 0.60
▸ HSPA5 P11021 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
SCHEMBL460754 0.88 TSHR (1.00) TSHRCYP2D6HIF1ACA12CA2
SCHEMBL2794849 0.84 CA12 (1.00) TSHRCYP2D6HIF1ACA12CA2
SCHEMBL12083246 0.84 TSHR (0.82) TSHRCYP2D6HIF1ACA12CA2
SCHEMBL31532322 0.84 CA12 (1.00) TSHRCYP2D6HIF1ACA12CA2
SCHEMBL1436928 0.83 CA12 (0.80) TSHRCYP2D6HIF1ACA12CA2
SCHEMBL29566183 0.83 CA12 (0.80) TSHRCYP2D6HIF1ACA12CA2
SCHEMBL7930135 0.82 TSHR (0.78) TSHRCYP2D6HIF1ACA12CA2
SCHEMBL30586211 0.82 CA12 (0.95) TSHRCYP2D6HIF1ACA12CA2
SCHEMBL30586212 0.82 CA12 (0.95) TSHRCYP2D6HIF1ACA12CA2
SCHEMBL30586214 0.82 CA12 (0.95) TSHRCYP2D6HIF1ACA12CA2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143363-B2 Polymerizable composition HENKEL AG & CO. KGAA (DE) 2012-03-27 — — US disclosed
EP-2297222-B1 POLYMERIZABLE COMPOSITION CONTAINING INORGANIC PARTICLES HAVING AN ORGANIC SHELL HENKEL AG & CO KGAA (DE) 2011-11-02 — — EP disclosed
US-20110105680-A1 Polymerizable Composition HENKEL AG & CO. KGAA (DE) 2011-05-05 — — US disclosed
WO-2010003800-A2 POLYMERIZABLE COMPOSITION HENKEL AG & CO. KGAA (DE) 2010-01-14 — — WO disclosed
WO-2010003940-A1 POLYMERIZABLE COMPOSITION CONTAINING INORGANIC PARTICLES HAVING AN ORGANIC SHELL HENKEL AG & CO. KGAA (DE) 2010-01-14 — — WO disclosed
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