SCHEMBL11032749

SCHEMBL11032749

CCCSP(=O)(OCC)Oc1ccc(C(C)(C)c2ccc(OP(=O)(OCC)SCCC)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
BCHE P06276 1/20 0.35
ACHE P22303 1/20 0.35

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
SCHEMBL11686871 0.91 LMNA (0.37) CA1CA2BCHEACHE
SCHEMBL11033933 0.89 CA1 (0.34) CA1CA2BCHEACHE
SCHEMBL11032770 0.88 MEN1 (0.41)
SCHEMBL11031581 0.82 CYP2C19 (0.37) CA1CA2BCHEACHE
SCHEMBL11033407 0.82 CYP2C19 (0.37) CA1CA2BCHEACHE
SCHEMBL10999297 0.82 MEN1 (0.46) CA1CA2BCHEACHE
SCHEMBL11034196 0.82 CA1 (0.37) CA1CA2BCHEACHE
SCHEMBL11033364 0.82 CA1 (0.37) CA1CA2BCHEACHE
SCHEMBL117138 0.82 L3MBTL1 (0.47) ACHE
SCHEMBL11038771 0.82 HDAC3 (0.39) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

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