SCHEMBL10693591

SCHEMBL10693591

CCN(CC)S(=O)(=O)c1ccc(N)c(Cl)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.60
MAPT P10636 2/20 0.60
VCAM1 P19320 1/20 0.57
CA12 O43570 1/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
CA4 P22748 1/20 0.56
CA6 P23280 1/20 0.56
CA5A P35218 1/20 0.56
CA7 P43166 1/20 0.56
CA9 Q16790 1/20 0.56
CA14 Q9ULX7 1/20 0.56
CA5B Q9Y2D0 1/20 0.56
POLB P06746 1/20 0.55
NPSR1 Q6W5P4 1/20 0.54
TSHR P16473 2/20 0.54
SMN1; SMN2 Q16637 4/20 0.53
LMNA P02545 2/20 0.53
HTT P42858 2/20 0.53
L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL5461567 0.87 ALDH1A1 (0.65) ALDH1A1MAPTVCAM1POLBNPSR1
SCHEMBL11520364 0.86 SERPINE1 (0.49) ALDH1A1MAPTVCAM1CA12CA1
SCHEMBL11684388 0.85 SERPINE1 (0.48) ALDH1A1MAPTVCAM1CA12CA1
SCHEMBL939122 0.84 POLB (0.63) ALDH1A1MAPTVCAM1POLBNPSR1
SCHEMBL11137915 0.81 POLB (0.56) ALDH1A1MAPTVCAM1POLBNPSR1
SCHEMBL14419604 0.81 POLB (0.56) ALDH1A1MAPTVCAM1POLBNPSR1
SCHEMBL11689596 0.81 ALDH1A1 (0.58) ALDH1A1MAPTVCAM1CA1CA2
SCHEMBL11039125 0.81 CA12 (0.61) ALDH1A1MAPTVCAM1CA12CA1
SCHEMBL11685605 0.81 VCAM1 (0.59) ALDH1A1MAPTVCAM1CA12CA1
SCHEMBL10693294 0.80 CA12 (0.58) ALDH1A1MAPTVCAM1CA12CA1

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 5 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-0026414-B1 WATER SOLUBLE MONOAZO COMPOUNDS, THEIR PREPARATION AND THEIR USE AS DYESTUFFS IN DYEING AND PRINTING TEXTILE MATERIALS, AS WELL AS THE AMINES PER SE CIBA-GEIGY AG (CH) 1985-04-10 EP disclosed
US-4467088-A USEFULL IN PREPARATION OF DYES CIBA-GEIGY CORPORATION (US) 1984-08-21 US disclosed
EP-0026414-A2 Water soluble monoazo compounds, their preparation and their use as dyestuffs in dyeing and printing textile materials, as well as the amines per se CIBA-GEIGY AG (CH) 1981-04-08 EP disclosed
US-4026931-A AZO DYES, FIBER-REACTIVE; INDOLE OR 5-AMINO-PYRAZOLE COUPLING COMPONENT BAYER AKTIENGESELLSCHAFT (DT) 1977-05-31 US disclosed