SCHEMBL8995513

SCHEMBL8995513

O=S(=O)(OCS)C1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.32
CA2 P00918 1/20 0.32
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
CA12 O43570 1/20 0.30
CA7 P43166 1/20 0.30
CA14 Q9ULX7 1/20 0.30

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
SCHEMBL8398627 0.77 CA1 (0.37) CA1CA2MEN1KMT2ACA12
SCHEMBL576133 0.76 CA1 (0.31) CA1CA2
SCHEMBL8397879 0.74 CA1 (0.39) CA1CA2
SCHEMBL9694025 0.74 CA12 (0.31) CA1CA2CA12
SCHEMBL8861302 0.74 CA1 (0.34) CA1CA2CA12
SCHEMBL576801 0.72
SCHEMBL8460195 0.72 ADH1B (0.31) CA1CA2
SCHEMBL4849848 0.72 CA1 (0.39) CA1CA2CA12CA7CA14
SCHEMBL6113279 0.72 CA1 (0.39) CA1CA2CA12CA7CA14
SCHEMBL8395884 0.71 CA1 (0.45) CA1CA2CA12CA7CA14

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
EP-0725771-A1 PROCESS FOR MAKING POLYPHENOLS FROM KETONES OR ALDEHYDES AND PHENOLS THE DOW CHEMICAL COMPANY (US) 1996-08-14 EP disclosed
WO-1996006819-A1 PROCESS FOR MAKING POLYPHENOLS FROM KETONES OR ALDEHYDES AND PHENOLS THE DOW CHEMICAL COMPANY (US) 1996-03-07 WO disclosed