SCHEMBL10482576

SCHEMBL10482576

OC(c1ccccc1)(c1ccccc1)C1CCN(CCNc2ccccn2)CC1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ HRH1 P35367 6/20 0.51
▸ KCNH2 Q12809 4/20 0.51
▸ MEN1 O00255 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ RECQL P46063 1/20 0.48
▸ NPSR1 Q6W5P4 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
SCHEMBL10568293 0.88 HRH1 (0.53) HRH1KCNH2MEN1HTTRECQL
SCHEMBL10479170 0.82 KCNH2 (0.47) HRH1KCNH2MEN1HTTRECQL
SCHEMBL3317162 0.80 HRH1 (0.48) HRH1KCNH2
SCHEMBL10568072 0.78 HRH1 (0.62) HRH1KCNH2
SCHEMBL10479193 0.78 NPC1 (0.51) HRH1KCNH2MEN1HTTRECQL
SCHEMBL28007048 0.76 HRH3 (0.54) —
SCHEMBL6506385 0.75 CYP1A2 (0.57) MEN1
SCHEMBL31690833 0.75 HRH3 (0.56) —
SCHEMBL10568040 0.75 HRH1 (0.56) HRH1KCNH2MEN1
SCHEMBL30608920 0.75 DRD2 (0.47) HRH1MEN1HTT

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
JP-1040479-A — — None — — JP disclosed
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