SCHEMBL8415596

SCHEMBL8415596

Cc1ccc(S(=O)(=O)NC(=O)NCCc2ccc(NC(=O)NS(=O)(=O)c3ccc(C)cc3)cc2)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 6/20 0.75
CA1 P00915 6/20 0.75
CA2 P00918 6/20 0.75
CA9 Q16790 6/20 0.75
TP53 P04637 1/20 0.64
CA4 P22748 1/20 0.64
CA6 P23280 1/20 0.64
CA5A P35218 1/20 0.64
CA7 P43166 1/20 0.64
CA13 Q8N1Q1 1/20 0.64
CA14 Q9ULX7 1/20 0.64
LMNA P02545 2/20 0.63
CNR1 P21554 1/20 0.62
PPARG P37231 2/20 0.61
RAB9A P51151 1/20 0.61
RXFP1 Q9HBX9 1/20 0.61
NR2E3 Q9Y5X4 1/20 0.61
NCOR2 Q9Y618 1/20 0.61
ALDH1A1 P00352 3/20 0.60
ALB P02768 1/20 0.60

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
SCHEMBL8927568 0.91 CA12 (0.72) CA12CA1CA2CA9TP53
SCHEMBL8717049 0.87 CA12 (0.67) CA12CA1CA2CA9TP53
SCHEMBL25003861 0.86 CA12 (0.81) CA12CA1CA2CA9TP53
SCHEMBL27680 0.85 CA12 (0.72) CA12CA1CA2CA9TP53
SCHEMBL1928662 0.85 CA12 (0.85) CA12CA1CA2CA9TP53
SCHEMBL6243996 0.85 CA12 (0.85) CA12CA1CA2CA9TP53
SCHEMBL5184802 0.85 CA12 (0.64) CA12CA1CA2CA9TP53
SCHEMBL19472792 0.84 CNR1 (0.69) CA12CA1CA2CA9CA4
SCHEMBL8712099 0.84 CA12 (0.70) CA12CA1CA2CA9TP53
SCHEMBL19472766 0.83 CNR1 (0.85) CNR1RAB9AALDH1A1CYP2C9

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
US-5990353-A DEMETALLIZING AN ARYLSULFONAMIDE ALKALI METAL SALT WITH AN AROMATIC ISOCYANATE COMPOUND IN AT LEAST ONE SOLVENT; USE AS A COLOR DEVELOPER FOR A THERMAL RECORDING MATERIAL WITH IMPROVED OIL RESISTANCE AND NONPLASTICIZED YAMAMOTO CHEMICALS, INC. (JP) 1999-11-23 US disclosed
EP-0879816-A1 Process for producing arylsulfonylureide compounds Yamamoto Chemicals, Inc. (JP) 1998-11-25 EP disclosed