SCHEMBL7709968

SCHEMBL7709968

CCOP(=O)(CC(=O)OCOC(=O)SCC)OCC

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
PPARD Q03181 1/20 0.36

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
SCHEMBL6885537 0.78 ACHE (0.37)
SCHEMBL16047 0.78 TSHR (0.48) TSHRPPARD
SCHEMBL18759661 0.78 TSHR (0.48) TSHRPPARD
SCHEMBL1331297 0.78 TSHR (0.48) TSHRPPARD
SCHEMBL7709958 0.77 TSHR (0.40) TSHRPPARD
SCHEMBL6669420 0.76 TSHR (0.46) TSHRPPARD
SCHEMBL30732776 0.74 TSHR (0.44) TSHRPPARD
SCHEMBL5326966 0.74 L3MBTL1 (0.31)
SCHEMBL1507260 0.74 NAAA (0.39) TSHR
SCHEMBL15438827 0.73 NAAA (0.44) TSHRPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6376548-B1 FUNGICIDES; HERBICIDES; INSECTICIDES ROHM AND HAAS COMPANY 2002-04-23 US disclosed
WO-2001056358-A2 ENHANCED PROPERTIED PESTICIDES ROHM AND HAAS COMPANY (US) 2001-08-09 WO disclosed