SCHEMBL27954382

SCHEMBL27954382

NS(=O)(=O)c1ccc(N2N=C(c3ccccc3Cl)CC2c2ccccc2O)cc1

nearest known ligand 0.77

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 9/20 0.77
▸ MMP9 P14780 8/20 0.77
▸ L3MBTL1 Q9Y468 4/20 0.69
▸ CA12 O43570 3/20 0.57
▸ CA9 Q16790 3/20 0.57
▸ PRKCZ Q05513 1/20 0.55
▸ CA1 P00915 3/20 0.54
▸ CA2 P00918 3/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ ALDH1A1 P00352 1/20 0.54
▸ GLA P06280 1/20 0.54
▸ GAA P10253 1/20 0.54
▸ MAPT P10636 1/20 0.54
▸ CFTR P13569 1/20 0.54
▸ HPGD P15428 1/20 0.54
▸ GOPC Q9HD26 1/20 0.54
▸ ATM Q13315 1/20 0.52
▸ MAOA P21397 1/20 0.51
▸ MAOB P27338 1/20 0.51

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
SCHEMBL27991879 0.87 MMP2 (1.00) MMP2MMP9L3MBTL1
SCHEMBL27944763 0.84 L3MBTL1 (0.69) MMP2MMP9L3MBTL1CA12CA9
SCHEMBL28810693 0.84 L3MBTL1 (0.79) MMP2MMP9L3MBTL1CA12CA9
SCHEMBL27954385 0.80 CA2 (0.76) MMP2MMP9L3MBTL1CA12CA9
SCHEMBL28808747 0.75 MMP2 (0.81) MMP2MMP9L3MBTL1CA1CA2
SCHEMBL5856319 0.74 PTGS1 (0.73) MMP2MMP9L3MBTL1
SCHEMBL27991839 0.73 MMP2 (0.75) MMP2MMP9L3MBTL1CA1CA2
SCHEMBL16740663 0.71 PRKCZ (1.00) MMP2MMP9L3MBTL1CA12CA9
SCHEMBL18826388 0.70 CA1 (0.91) MMP2MMP9L3MBTL1CA12CA9
SCHEMBL5857978 0.70 CA2 (0.56) MMP2MMP9L3MBTL1CA1CA2

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
CN-103664786-A Synthesis method of dihydro-pyrazole sulfonamide derivatives of salicylaldehydes and application of dihydro-pyrazole sulfonamide derivatives to preparation of anticancer drugs NANJING UNIVERSITY OF TECHNOLOGY 2014-03-26 — — CN disclosed
Send feedback