SCHEMBL10479191

SCHEMBL10479191

Nc1cccnc1NCCCN1CCC(C(O)(c2ccc(F)cc2)c2ccccn2)CC1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 9/20 0.49
▸ KMT2A Q03164 4/20 0.41
▸ HRH1 P35367 2/20 0.39
▸ KCNH2 Q12809 1/20 0.38

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
SCHEMBL10479198 0.83 MEN1 (0.56) MEN1KMT2AHRH1KCNH2
SCHEMBL9786921 0.82 MEN1 (0.57) MEN1KMT2AHRH1KCNH2
SCHEMBL10479170 0.80 KCNH2 (0.47) MEN1HRH1KCNH2
SCHEMBL9874231 0.78 MEN1 (0.51) MEN1KMT2AHRH1KCNH2
SCHEMBL9873531 0.78 MEN1 (0.51) MEN1HRH1
SCHEMBL10479173 0.77 MEN1 (0.57) MEN1KMT2A
SCHEMBL9873458 0.76 MEN1 (0.51) MEN1KMT2A
SCHEMBL9874473 0.76 MEN1 (0.51) MEN1KMT2AHRH1KCNH2
SCHEMBL9873310 0.75 MEN1 (0.49) MEN1
SCHEMBL9873147 0.75 MEN1 (0.51) MEN1KMT2AHRH1KCNH2

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-4806560-A ANTIHISTAMINES AND ANTISEROTONINE AGENTS SYNTHELABO (FR) 1989-02-21 — — US disclosed
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