SCHEMBL10722932

SCHEMBL10722932

NS(=O)(=O)c1ccc(OCCCN2CCC(C(O)(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.67
▸ KMT2A Q03164 3/20 0.64
▸ KCNH2 Q12809 5/20 0.58
▸ HRH3 Q9Y5N1 5/20 0.58
▸ PAX8 Q06710 1/20 0.52

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
Hydrochloric Acid SCHEMBL10459167 0.99 MEN1 (0.66) MEN1KMT2AKCNH2HRH3PAX8
SCHEMBL10719616 0.90 KCNH2 (0.58) MEN1KMT2AKCNH2HRH3PAX8
SCHEMBL16307518 0.90 KCNH2 (0.72) MEN1KMT2AKCNH2HRH3PAX8
SCHEMBL10461861 0.89 KCNH2 (0.70) MEN1KMT2AKCNH2HRH3PAX8
SCHEMBL10460508 0.86 KCNH2 (0.64) MEN1KMT2AKCNH2HRH3PAX8
SCHEMBL10459137 0.84 KCNH2 (0.59) MEN1KMT2AKCNH2HRH3PAX8
Fumaric Acid SCHEMBL10555655 0.84 KCNH2 (0.54) MEN1KMT2AKCNH2PAX8
SCHEMBL9492355 0.84 KCNH2 (0.49) MEN1KMT2AKCNH2PAX8
SCHEMBL10459164 0.84 KCNH2 (0.64) MEN1KMT2AKCNH2HRH3PAX8
SCHEMBL10460419 0.84 KCNH2 (0.64) MEN1KMT2AKCNH2HRH3PAX8

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
EP-0235463-A2 N-substituted-arylalkyl and arylalkylene piperidines as cardiovascular antihistaminic and antisecretory agents A.H. ROBINS COMPANY, INCORPORATED (a Delaware corporation) (US) 1987-09-09 — — EP claimed
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