SCHEMBL31735982

SCHEMBL31735982

CC1(c2ccccc2S(N)(=O)=O)CC1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA2 P00918 14/20 0.45
CA9 Q16790 11/20 0.45
CA1 P00915 10/20 0.45
CA12 O43570 6/20 0.45
CA6 P23280 4/20 0.45
CA5A P35218 4/20 0.45
CA4 P22748 3/20 0.45
CA7 P43166 3/20 0.45
CA5B Q9Y2D0 3/20 0.45
CA14 Q9ULX7 2/20 0.45
CYP2C9 P11712 1/20 0.45
MAPK1 P28482 1/20 0.37
LDHA P00338 1/20 0.36
CDK2 P24941 1/20 0.36
PTGES2 Q9H7Z7 1/20 0.36
PNMT P11086 1/20 0.36
CA3 P07451 1/20 0.35
PLA2G7 Q13093 1/20 0.35
CA13 Q8N1Q1 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
SCHEMBL18590932 1.00 CA2 (0.45) CA2CA9CA1CA12CA6
SCHEMBL32664646 0.84 CA2 (0.42) CA2CA9CA1CA12CA6
SCHEMBL21817054 0.78 CA2 (0.42) CA2CA9CA1CA12CA6
SCHEMBL16014743 0.75 CA2 (0.39) CA2CA9CA1CA12CA6
SCHEMBL6552316 0.73 HTR2A (0.39)
SCHEMBL8510502 0.72 CA1 (0.47) CA2CA9CA1CA12CA6
SCHEMBL202947 0.71 CA2 (0.70) CA2CA9CA1CA12CA6
SCHEMBL20153473 0.70 PNMT (0.40) CA2CA9CA1CA12CA6
SCHEMBL5500843 0.70 CA2 (0.39) CA2CA9CA1CA12CA6
SCHEMBL8193758 0.70 SIGMAR1 (0.50) CA2CA9CA1CA12CA6

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
WO-2025245087-A1 HETEROCYCLIC COMPOUNDS AS PARG INHIBITORS SYNNOVATION THERAPEUTICS, INC. (US) 2025-11-27 WO disclosed