SCHEMBL19576930

SCHEMBL19576930

CCc1ccccc1CC(=O)Nc1ccc(-c2cncc(OC)c2)c(S(N)(=O)=O)c1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ P2RX4 Q99571 18/20 0.53
▸ CTPS1 P17812 1/20 0.44
▸ ROCK2 O75116 1/20 0.43
▸ ROCK1 Q13464 1/20 0.43

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
SCHEMBL19551566 0.91 P2RX4 (0.65) P2RX4ROCK2ROCK1
SCHEMBL29716911 0.91 P2RX4 (0.65) P2RX4ROCK2ROCK1
SCHEMBL29716925 0.79 P2RX4 (0.62) P2RX4
SCHEMBL29716908 0.79 P2RX4 (0.62) P2RX4
SCHEMBL19551702 0.79 P2RX4 (0.62) P2RX4
SCHEMBL19551804 0.79 P2RX4 (0.62) P2RX4
SCHEMBL19576896 0.78 P2RX4 (0.61) P2RX4
SCHEMBL19551955 0.78 P2RX4 (0.54) P2RX4
SCHEMBL19551541 0.78 P2RX4 (0.70) P2RX4
SCHEMBL29716996 0.78 P2RX4 (0.54) P2RX4

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-3458443-B1 AROMATIC SULFONAMIDE DERIVATIVES Bayer Pharma AG (DE) 2020-08-19 — — EP disclosed
WO-2017191000-A1 AROMATIC SULFONAMIDE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-11-09 — — WO disclosed
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