SCHEMBL10479170

SCHEMBL10479170

Nc1cccnc1NCCN1CCC(C(O)(c2ccccc2)c2ccccc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 4/20 0.47
▸ HRH1 P35367 6/20 0.47
▸ MEN1 O00255 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ RECQL P46063 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL10568293 0.84 HRH1 (0.53) KCNH2HRH1MEN1HTTRECQL
SCHEMBL10479193 0.83 NPC1 (0.51) KCNH2HRH1MEN1HTTRECQL
SCHEMBL10482576 0.82 HRH1 (0.51) KCNH2HRH1MEN1HTTRECQL
SCHEMBL10479191 0.80 MEN1 (0.49) KCNH2HRH1MEN1
SCHEMBL6530243 0.76 KDM4E (0.52) KCNH2MEN1
SCHEMBL10568072 0.75 HRH1 (0.62) KCNH2HRH1
SCHEMBL10479209 0.73 HRH1 (0.63) KCNH2HRH1
SCHEMBL3317162 0.72 HRH1 (0.48) KCNH2HRH1
SCHEMBL10568040 0.71 HRH1 (0.56) KCNH2HRH1MEN1
SCHEMBL6619451 0.71 HRH1 (0.64) KCNH2HRH1MEN1HTTNPSR1

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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