SCHEMBL10722048

SCHEMBL10722048

CC(c1cc2ccccc2[nH]1)S(N)(=O)=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 2/20 0.53
▸ ALOX5 P09917 1/20 0.52
▸ CA12 O43570 1/20 0.45
▸ CA1 P00915 1/20 0.45
▸ CA9 Q16790 1/20 0.45
▸ AOC3 Q16853 2/20 0.43
▸ DAO P14920 2/20 0.42
▸ BRD4 O60885 1/20 0.42
▸ DDO Q99489 1/20 0.42
▸ KDM4E B2RXH2 7/20 0.42
▸ LMNA P02545 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ LOXL2 Q9Y4K0 1/20 0.40
▸ FLT3 P36888 1/20 0.40
▸ CYP2A6 P11509 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ MAPT P10636 2/20 0.39
▸ TSHR P16473 1/20 0.39
▸ HSD17B10 Q99714 2/20 0.39

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
SCHEMBL3229357 0.77 ALOX5 (0.55) CA2ALOX5AOC3DAOBRD4
SCHEMBL3663172 0.77 ALOX5 (0.55) CA2ALOX5CA12CA1CA9
SCHEMBL5320663 0.76 ALOX5 (0.49) CA2ALOX5CA12CA1CA9
SCHEMBL336690 0.76 ALOX5 (0.54) CA2ALOX5AOC3DAOBRD4
SCHEMBL4985929 0.76 ALOX5 (0.54) CA2ALOX5AOC3DAOBRD4
SCHEMBL30733359 0.76 ALOX5 (0.54) CA2ALOX5AOC3DAOBRD4
SCHEMBL417540 0.73 ALOX5 (0.64) CA2ALOX5AOC3DAOBRD4
SCHEMBL243889 0.73 ALOX5 (0.46) CA2ALOX5CA12CA1CA9
SCHEMBL1706542 0.73 ALOX5 (0.51) CA2ALOX5AOC3DAOBRD4
SCHEMBL31299796 0.73 ALOX5 (0.55) ALOX5AOC3DAOBRD4DDO

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
EP-0242767-A2 N-dihydroindolyl ethyl-sulfon amides BAYER AG (DE) 1987-10-28 — — EP claimed
EP-0242767-A2 N-dihydroindolyl ethyl-sulfon amides BAYER AG (DE) 1987-10-28 — — EP disclosed
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