SCHEMBL10719616

SCHEMBL10719616

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

nearest known ligand 0.71

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.58
▸ MEN1 O00255 6/20 0.55
▸ PAX8 Q06710 1/20 0.54
▸ KMT2A Q03164 3/20 0.53
▸ NPY2R P49146 1/20 0.50
▸ HRH3 Q9Y5N1 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
Fumaric Acid SCHEMBL10555655 0.94 KCNH2 (0.54) KCNH2MEN1PAX8KMT2ANPY2R
SCHEMBL10722932 0.90 MEN1 (0.67) KCNH2MEN1PAX8KMT2AHRH3
SCHEMBL16307528 0.90 KCNH2 (0.72) KCNH2MEN1PAX8KMT2ANPY2R
SCHEMBL10461861 0.89 KCNH2 (0.70) KCNH2MEN1PAX8KMT2AHRH3
Hydrochloric Acid SCHEMBL10459167 0.89 MEN1 (0.66) KCNH2MEN1PAX8KMT2AHRH3
SCHEMBL10460876 0.87 KCNH2 (0.55) KCNH2MEN1PAX8KMT2ANPY2R
SCHEMBL10460419 0.86 KCNH2 (0.64) KCNH2MEN1PAX8KMT2AHRH3
SCHEMBL10461340 0.86 KCNH2 (0.64) KCNH2MEN1PAX8KMT2AHRH3
SCHEMBL10459164 0.86 KCNH2 (0.64) KCNH2MEN1PAX8KMT2AHRH3
SCHEMBL10460724 0.86 KCNH2 (0.64) KCNH2MEN1PAX8KMT2ANPY2R

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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