SCHEMBL8795185

SCHEMBL8795185

COc1ccc(S(=O)(=O)NCCCCOc2ccc(-n3ccnc3)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.61
KMT2A Q03164 1/20 0.61
ALDH1A1 P00352 3/20 0.57
PKM P14618 1/20 0.57
CYP2D6 P10635 6/20 0.56
CYP2C9 P11712 6/20 0.56
CYP3A4 P08684 5/20 0.56
CYP1A2 P05177 4/20 0.56
CYP2C19 P33261 4/20 0.56
CYP19A1 P11511 1/20 0.56
CA1 P00915 2/20 0.53
CA2 P00918 2/20 0.53
CA9 Q16790 2/20 0.53
HTR7 P34969 1/20 0.49
USP2 O75604 1/20 0.49
LMNA P02545 1/20 0.48
HPGD P15428 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL8482499 0.93 CYP2D6 (0.67) MEN1KMT2AALDH1A1CYP2D6CYP2C9
SCHEMBL8487591 0.92 ALDH1A1 (0.57) MEN1KMT2AALDH1A1PKMCYP2D6
SCHEMBL8794686 0.89 CYP2D6 (0.53) MEN1KMT2ACYP2D6CYP2C9CYP3A4
SCHEMBL8795789 0.89 MEN1 (0.61) MEN1KMT2ACYP2D6CYP2C9CYP3A4
SCHEMBL8795193 0.89 CYP2D6 (0.53) MEN1KMT2ACYP2D6CYP2C9CYP3A4
SCHEMBL8483983 0.89 CYP2D6 (0.55) MEN1KMT2AALDH1A1PKMCYP2D6
SCHEMBL8487067 0.89 MAPT (0.56) MEN1KMT2AALDH1A1CYP2D6CYP2C9
SCHEMBL8795018 0.88 CYP2D6 (0.52) MEN1KMT2ACYP2D6CYP2C9CYP3A4
SCHEMBL8484029 0.88 CYP2D6 (0.54) MEN1KMT2AALDH1A1PKMCYP2D6
SCHEMBL8525293 0.88 CYP2D6 (0.51) MEN1KMT2ACYP2D6CYP2C9CYP3A4

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-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