SCHEMBL30041571

SCHEMBL30041571

NS(=O)(=O)CCCCCS(N)(=O)=O

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA2 P00918 14/20 0.48
CA1 P00915 7/20 0.38
CA9 Q16790 7/20 0.38
CA4 P22748 3/20 0.38
CA6 P23280 3/20 0.38
CA5A P35218 3/20 0.38
CA7 P43166 3/20 0.38
CA5B Q9Y2D0 3/20 0.38
CA12 O43570 2/20 0.38
CA3 P07451 2/20 0.38
CA14 Q9ULX7 2/20 0.38
FAAH O00519 2/20 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
SCHEMBL11147913 1.00 CA2 (0.48) CA2CA1CA9CA4CA6
SCHEMBL10798852 1.00 CA2 (0.48) CA2CA1CA9CA4CA6
SCHEMBL8069056 1.00 CA2 (0.48) CA2CA1CA9CA4CA6
SCHEMBL10457263 0.96 CA2 (0.43) CA2CA1CA9CA4CA6
SCHEMBL10405537 0.88 CA2 (0.39) CA2CA1CA9CA4CA6
SCHEMBL15562346 0.87 CA2 (0.41) CA2CA1CA9CA4CA6
SCHEMBL3230334 0.87 DNM1 (0.47) CA2CA1CA9CA4CA6
SCHEMBL4020896 0.87 DNM1 (0.47) CA2CA1CA9CA4CA6
SCHEMBL11110360 0.85 CA2 (0.39) CA2CA1CA9CA4CA6
SCHEMBL19900115 0.85 CA2 (0.39) CA2CA1CA9CA4CA6

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
EP-3883865-B1 SEAL OF A PORTION CAPSULE GCS GERMAN CAPSULE SOLUTION GMBH (DE) 2022-11-09 EP disclosed