SCHEMBL4032876

SCHEMBL4032876

O=C(O)Oc1cnc(N2CCC(CC3CCN(C4CCC4)CC3)CC2)cn1

nearest known ligand 0.42

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 18/20 0.42

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
SCHEMBL4039849 0.84 HRH3 (0.48) HRH3
SCHEMBL4032468 0.82 HRH3 (0.42) HRH3
Hydrochloric Acid SCHEMBL4037289 0.81 HRH3 (0.41) HRH3
SCHEMBL4034618 0.79 HRH3 (0.41) HRH3
SCHEMBL4031091 0.79 HRH3 (0.51) HRH3
SCHEMBL4034675 0.77 PARP1 (0.42) HRH3
SCHEMBL4034282 0.76 HRH3 (0.48) HRH3
SCHEMBL4034857 0.75 HRH3 (0.48) HRH3
SCHEMBL4031088 0.74 HRH3 (0.39) HRH3
SCHEMBL4031778 0.74 HRH3 (0.66) HRH3

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
EP-1789410-B1 METHYLENE DIPIPERIDINE DERIVATIVES GLAXO GROUP LTD (GB) 2009-06-17 EP claimed