SCHEMBL8536666

SCHEMBL8536666

Oc1ccccc1OCCCN1CCC(C(O)(c2ccc(F)cc2)c2ccc(F)cc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 2/20 0.57
▸ MEN1 O00255 1/20 0.54
▸ PAX8 Q06710 1/20 0.52
▸ KDM4E B2RXH2 1/20 0.48
▸ HRH1 P35367 2/20 0.47

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
SCHEMBL10557081 0.88 PAX8 (0.60) KCNH2MEN1PAX8HRH1
SCHEMBL10461602 0.88 KCNH2 (0.56) KCNH2MEN1PAX8HRH1
SCHEMBL10460949 0.86 KCNH2 (0.73) KCNH2MEN1PAX8HRH1
SCHEMBL10461612 0.86 KCNH2 (0.57) KCNH2MEN1PAX8HRH1
SCHEMBL10461458 0.85 KCNH2 (0.53) KCNH2MEN1PAX8HRH1
SCHEMBL10461861 0.84 KCNH2 (0.70) KCNH2MEN1PAX8
SCHEMBL10461068 0.84 MAPT (0.57) KCNH2MEN1PAX8HRH1
SCHEMBL10460576 0.82 KCNH2 (0.85) KCNH2MEN1PAX8HRH1
Oxalic Acid SCHEMBL10461512 0.82 KCNH2 (0.67) KCNH2MEN1PAX8KDM4E
SCHEMBL10460508 0.82 KCNH2 (0.64) KCNH2MEN1PAX8

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0508334-B1 Novel aminophenol derivatives and pharmaceutical compositions thereof GREEN CROSS CORP (JP) 1998-01-07 — — EP disclosed
US-4950674-A Arylalkylheterocyclic amines,N-substituted by aryloxyalkyl group in a method for allergy treatment A. H. ROBINS COMPANY, INCORPORATED (US) 1990-08-21 — — US disclosed
US-4810713-A Arylalkyl-heterocyclic amines, n-substituted by aryloxyalkyl groups used in a method for allergy treatment A. H. ROBINS COMPANY, INCORPORATED (US) 1989-03-07 — — US disclosed
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 disclosed
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