SCHEMBL7625575

SCHEMBL7625575

COC(=S)P(=O)(OC)OC

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL5683228 0.73
SCHEMBL5681920 0.71
SCHEMBL842263 0.67 ALDH1A1 (0.37) CA12CA1CA2CA9L3MBTL1
SCHEMBL7623175 0.65
SCHEMBL5681925 0.65
SCHEMBL7449805 0.65 ALDH1A1 (0.33) L3MBTL1
SCHEMBL11343993 0.65 ALDH1A1 (0.33)
SCHEMBL24114271 0.65 L3MBTL1 (0.30) L3MBTL1
SCHEMBL11340495 0.65 ALDH1A1 (0.33) L3MBTL1
SCHEMBL15088191 0.63 ALDH1A1 (0.38) CA12CA1CA2CA9L3MBTL1

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-6444837-B1 VIRICIDES UNIVERSITY OF SOUTHERN CALIFORNIA 2002-09-03 US disclosed