SCHEMBL11034196

SCHEMBL11034196

CCCSP(=O)(OCC)Oc1ccc(S)cc1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.37

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
SCHEMBL11033407 0.85 CYP2C19 (0.37) CA1CA2BCHEACHE
SCHEMBL10999297 0.85 MEN1 (0.46) CA1CA2BCHEACHE
SCHEMBL11033364 0.85 CA1 (0.37) CA1CA2BCHEACHE
SCHEMBL11031581 0.85 CYP2C19 (0.37) CA1CA2BCHEACHE
SCHEMBL117138 0.84 L3MBTL1 (0.47) ACHE
SCHEMBL9009188 0.84 CA1 (0.37) CA1CA2BCHEACHE
SCHEMBL11032749 0.82 CA1 (0.35) CA1CA2BCHEACHE
SCHEMBL11033617 0.82 ENPP2 (0.38)
SCHEMBL11866713 0.82 LTA4H (0.44) ACHE
SCHEMBL11033859 0.82 KMT2A (0.43) CA1CA2BCHEACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4457922-A INSECTICIDES, MITICIDES UNION CARBIDE CORPORATION (US) 1984-07-03 US disclosed