SCHEMBL11056133

SCHEMBL11056133

Nc1c(Br)ccc(S(=O)(=O)O)c1Br

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.37
AURKA O14965 1/20 0.36
AURKB Q96GD4 1/20 0.36
ALDH1A1 P00352 7/20 0.35
NT5E P21589 2/20 0.35
TSHR P16473 2/20 0.35
CA2 P00918 4/20 0.34
CA1 P00915 3/20 0.34
CA4 P22748 2/20 0.34
CA6 P23280 2/20 0.34
CA9 Q16790 2/20 0.34
CA3 P07451 1/20 0.34
RAPGEF4 Q8WZA2 1/20 0.33
SUMO2 P61956 2/20 0.32
SUMO1 P63165 2/20 0.32
SENP7 Q9BQF6 2/20 0.32
SENP2 Q9HC62 2/20 0.32
SENP1 Q9P0U3 2/20 0.32
HSD17B10 Q99714 4/20 0.31
TDP1 Q9NUW8 4/20 0.31

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
SCHEMBL9615691 0.80 CA2 (0.33) TTRAURKAAURKBALDH1A1NT5E
SCHEMBL31357038 0.80 CA2 (0.33) TTRAURKAAURKBALDH1A1NT5E
SCHEMBL11815424 0.80 MEN1 (0.39) TTRAURKAAURKBALDH1A1NT5E
SCHEMBL11820472 0.80 CYP2C9 (0.36) TTRAURKAAURKBALDH1A1NT5E
SCHEMBL27499155 0.77 AURKA (0.44) TTRAURKAAURKBALDH1A1NT5E
SCHEMBL10424160 0.77 MEN1 (0.36) TTRAURKAAURKBALDH1A1CA2
SCHEMBL22394908 0.75 MYC (0.35) ALDH1A1TSHRCA2CA1CA4
SCHEMBL27881048 0.74 TTR (0.46) TTRAURKAAURKBALDH1A1NT5E
SCHEMBL15309350 0.73 DAPK1 (0.43) TTRAURKAAURKBALDH1A1NT5E
SCHEMBL1301837 0.72 CA1 (0.34) TTRAURKAAURKBALDH1A1CA2

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
US-4486347-A Flame retarding antimicrobial halogenated azo dyestuffs TSENTRALNY NAUCHNOISSLEDOVATELSKY INSTITUT SHERSTI (SU) 1984-12-04 US disclosed