SCHEMBL7012189

SCHEMBL7012189

NC(=O)Cc1ccc(S(=O)(=O)Nc2cccc3c(Cl)c[nH]c23)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.71
CA2 P00918 3/20 0.71
CA12 O43570 2/20 0.71
CA9 Q16790 2/20 0.71
CA3 P07451 1/20 0.71
CA6 P23280 1/20 0.71
CA5A P35218 1/20 0.71
CA7 P43166 1/20 0.71
CRBN Q96SW2 1/20 0.71
CA14 Q9ULX7 1/20 0.71
CA5B Q9Y2D0 1/20 0.71
IMPDH2 P12268 1/20 0.43
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 2/20 0.43
HAT1 O14929 1/20 0.41
EP300 Q09472 1/20 0.41
ALOX12 P18054 1/20 0.40
PTGER3 P43115 1/20 0.39
MEN1 O00255 5/20 0.38
KMT2A Q03164 5/20 0.38

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
SCHEMBL12190471 0.87 CA1 (0.79) CA1CA2CA12CA9CA3
SCHEMBL5255065 0.86 CA1 (0.64) CA1CA2CA12CA9CA3
SCHEMBL3065912 0.85 CA2 (0.76) CA1CA2CA12CA9CA3
SCHEMBL3071891 0.84 CA1 (0.78) CA1CA2CA12CA9CA3
SCHEMBL30241706 0.84 CA1 (0.67) CA1CA2CA12CA9CA3
SCHEMBL26150078 0.84 CA1 (0.67) CA1CA2CA12CA9CA3
Indisulam SCHEMBL29799438 0.83 CA1 (1.00) CA1CA2CA12CA9CA3
Indisulam SCHEMBL91389 0.83 CA1 (1.00) CA1CA2CA12CA9CA3
SCHEMBL3068025 0.83 CA1 (0.76) CA1CA2CA12CA9CA3
SCHEMBL3060876 0.82 CA1 (0.74) CA1CA2CA12CA9CA3

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-0673937-B1 BICYCLIC HETEROCYCLIC SULFONAMIDE AND SULFONIC ESTER DERIVATIVES EISAI CO LTD (JP) 2003-11-26 EP claimed
EP-0673937-A1 BICYCLIC HETEROCYCLIC SULFONAMIDE AND SULFONIC ESTER DERIVATIVES Eisai Co., Ltd. (JP) 1995-09-27 EP claimed