SCHEMBL10692669

SCHEMBL10692669

Nc1ccc(S(=O)(=O)Nc2ccc(S(=O)(=O)O)cc2)cc1Cl

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.57
NPSR1 Q6W5P4 1/20 0.57
CA1 P00915 2/20 0.51
CA2 P00918 2/20 0.51
CA9 Q16790 2/20 0.51
CA12 O43570 1/20 0.51
CA4 P22748 1/20 0.51
CA6 P23280 1/20 0.51
CA5A P35218 1/20 0.51
CA7 P43166 1/20 0.51
CA14 Q9ULX7 1/20 0.51
CA5B Q9Y2D0 1/20 0.51
CES1 P23141 1/20 0.49
ALDH1A1 P00352 3/20 0.48
LMNA P02545 1/20 0.48
PGR P06401 1/20 0.48
CYP3A4 P08684 1/20 0.47
THRB P10828 1/20 0.47
HPGD P15428 1/20 0.47
ALOX15 P16050 1/20 0.47

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
SCHEMBL5225275 0.88 CES1 (0.66) MAPTNPSR1CA1CA2CA9
SCHEMBL5737571 0.86 CA1 (0.67) MAPTNPSR1CA1CA2CA9
SCHEMBL10693412 0.84 KMT2A (0.60) MAPTNPSR1CA1CA2CA9
SCHEMBL10694559 0.82 MAPT (0.51) MAPTNPSR1CA1CA2CA9
SCHEMBL11687178 0.82 MAPT (0.53) MAPTNPSR1ALDH1A1LMNAPGR
SCHEMBL31208448 0.82 CA1 (0.68) MAPTCA1CA2CA9CA12
SCHEMBL879153 0.82 CA1 (0.68) MAPTCA1CA2CA9CA12
Methane SCHEMBL11685427 0.81 MAPT (0.50) MAPTNPSR1CA1CA2CA9
SCHEMBL5737038 0.81 PGR (0.63) MAPTALDH1A1LMNAPGRHPGD
SCHEMBL5737651 0.81 ALDH1A1 (0.62) MAPTNPSR1ALDH1A1LMNATHRB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4754024-A Fibre-reactive azo dyes containing vinylsulfonyl or analogous groups CIBA-GEIGY CORPORATION 1988-06-28 US disclosed
EP-0112285-B1 REACTIVE DYES, THEIR PREPARATION AND THEIR USE CIBA-GEIGY AG (CH) 1987-03-18 EP disclosed
EP-0112285-A2 Reactive dyes, their preparation and their use CIBA-GEIGY AG (CH) 1984-06-27 EP disclosed