SCHEMBL8486316

SCHEMBL8486316

O=C(c1ccccc1)c1ccc(OCCCCNS(=O)(=O)c2ccc(Br)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 1/20 0.52
▸ SGMS1 Q86VZ5 1/20 0.52
▸ MEN1 O00255 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ HTT P42858 1/20 0.51
▸ ITGA1 P56199 1/20 0.49
▸ ALDH1A1 P00352 3/20 0.49
▸ GAA P10253 2/20 0.49
▸ CA12 O43570 4/20 0.48
▸ CA1 P00915 4/20 0.48
▸ CA2 P00918 4/20 0.48
▸ CA9 Q16790 4/20 0.48
▸ CA4 P22748 1/20 0.48
▸ MMP2 P08253 5/20 0.47
▸ HPGD P15428 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ MMP14 P50281 2/20 0.46

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
SCHEMBL8794869 0.86 L3MBTL1 (0.56) MEN1KMT2AHTTALDH1A1GAA
SCHEMBL8488181 0.82 PGR (0.59) PPARAMEN1KMT2AHTTALDH1A1
SCHEMBL18573443 0.80 ALDH1A1 (0.56) PPARAMEN1KMT2AHTTALDH1A1
Bromide SCHEMBL18553827 0.79 ALDH1A1 (0.55) PPARAMEN1KMT2AHTTALDH1A1
SCHEMBL27508683 0.78 MEN1 (0.53) SGMS1MEN1KMT2AHTTALDH1A1
SCHEMBL1876555 0.78 ALDH1A1 (0.71) MEN1KMT2AHTTALDH1A1KDM4E
SCHEMBL8488202 0.78 GAA (0.56) MEN1KMT2AHTTALDH1A1GAA
Bromide SCHEMBL18553815 0.78 ALDH1A1 (0.53) PPARAMEN1KMT2AHTTALDH1A1
SCHEMBL10613191 0.77 MEN1 (0.60) MEN1KMT2AHTTALDH1A1CA12
SCHEMBL11485988 0.76 PPARA (0.83) PPARAHTTALDH1A1GAAKDM4E

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-5877196-A N- 4-(imidazolyl or pyrazolyl)phenyl(oxy, sulfinyl, sulfenyl or sulfonyl)alkyl!carboxamides, sulfonamides or phosphoramides having antiarrhythmic properties AMERICAN CYANAMID COMPANY (US) 1999-03-02 — — US disclosed
EP-0792873-A1 N-(Phenoxyalkyl) carboxamides and their use as antiarrhythmic agents American Cyanamid Company (US) 1997-09-03 — — EP disclosed
Send feedback