SCHEMBL8487175

SCHEMBL8487175

O=S(=O)(NCCCCOc1ccc(-c2cc[nH]n2)cc1)c1ccc(Br)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ GAA P10253 1/20 0.47
▸ ALDH1A1 P00352 4/20 0.44
▸ PKM P14618 1/20 0.44
▸ HTR1A P08908 1/20 0.43
▸ HTR1D P28221 1/20 0.43
▸ HTR1B P28222 1/20 0.43
▸ HTT P42858 1/20 0.41
▸ SGMS1 Q86VZ5 1/20 0.41
▸ MMP2 P08253 2/20 0.40
▸ MMP14 P50281 2/20 0.40
▸ MMP9 P14780 1/20 0.40
▸ ADAM17 P78536 1/20 0.40
▸ ALPL P05186 1/20 0.40
▸ ALPI P09923 1/20 0.40
▸ ALPG P10696 1/20 0.40
▸ ADAMTS4 O75173 1/20 0.40
▸ MMP1 P03956 1/20 0.40
▸ MMP13 P45452 1/20 0.40

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
SCHEMBL8486924 0.89 ALDH1A1 (0.52) MEN1KMT2AALDH1A1PKMHTR1A
SCHEMBL8795364 0.81 CYP2D6 (0.52) MEN1KMT2AGAAALDH1A1PKM
SCHEMBL8488202 0.76 GAA (0.56) MEN1KMT2AGAAALDH1A1PKM
SCHEMBL8794869 0.74 L3MBTL1 (0.56) MEN1KMT2AGAAALDH1A1PKM
SCHEMBL8486316 0.73 PPARA (0.52) MEN1KMT2AGAAALDH1A1PKM
SCHEMBL27508683 0.72 MEN1 (0.53) MEN1KMT2AGAAALDH1A1PKM
SCHEMBL27508684 0.72 MEN1 (0.53) MEN1KMT2AGAAALDH1A1PKM
SCHEMBL8795501 0.72 KDM4E (0.53) MEN1KMT2AGAAALDH1A1PKM
SCHEMBL8794686 0.72 CYP2D6 (0.53) MEN1KMT2AGAA
SCHEMBL9780583 0.72 ALDH1A1 (0.67) MEN1KMT2AGAAALDH1A1PKM

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 3 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 claimed
EP-0792873-A1 N-(Phenoxyalkyl) carboxamides and their use as antiarrhythmic agents American Cyanamid Company (US) 1997-09-03 — — EP claimed
EP-0792873-A1 N-(Phenoxyalkyl) carboxamides and their use as antiarrhythmic agents American Cyanamid Company (US) 1997-09-03 — — EP disclosed
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