SCHEMBL10568040

SCHEMBL10568040

CN(CCN1CCC(C(O)(c2ccccc2)c2ccccc2)CC1)c1ncccn1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ HRH1 P35367 5/20 0.56
▸ KCNH2 Q12809 3/20 0.52
▸ MEN1 O00255 1/20 0.49
▸ CYP2J2 P51589 1/20 0.49

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
SCHEMBL55533 0.77 HRH1 (0.67) HRH1KCNH2CYP2J2
SCHEMBL10568293 0.77 HRH1 (0.53) HRH1KCNH2MEN1
SCHEMBL10570042 0.75 HRH1 (0.53) HRH1KCNH2MEN1CYP2J2
SCHEMBL16291199 0.75 KCNH2 (0.67) HRH1KCNH2MEN1CYP2J2
SCHEMBL10482576 0.75 HRH1 (0.51) HRH1KCNH2MEN1
SCHEMBL8317518 0.75 HRH1 (0.58) HRH1KCNH2MEN1CYP2J2
SCHEMBL10479209 0.74 HRH1 (0.63) HRH1KCNH2
SCHEMBL14020878 0.74 HRH1 (0.65) HRH1KCNH2
SCHEMBL17023773 0.74 HRH1 (0.77) HRH1KCNH2CYP2J2
SCHEMBL10568072 0.74 HRH1 (0.62) HRH1KCNH2

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
US-4853387-A Piperidine derivatives, and their application in therapy SYNTHELABO (FR) 1989-08-01 — — US disclosed
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