SCHEMBL22211358

SCHEMBL22211358

CN1CCC2CCN(Cl)CC21

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.34
L3MBTL3 Q96JM7 1/20 0.33
CHRM2 P08172 2/20 0.30

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
SCHEMBL22211389 0.76 HRH3 (0.36) HRH3L3MBTL3CHRM2
SCHEMBL22211388 0.76 HRH3 (0.36) HRH3L3MBTL3CHRM2
SCHEMBL14971171 0.76 HRH3 (0.36) HRH3L3MBTL3CHRM2
SCHEMBL20070293 0.74 HRH3 (0.35) HRH3L3MBTL3CHRM2
SCHEMBL23690636 0.73 HRH3 (0.34) HRH3L3MBTL3CHRM2
SCHEMBL21792599 0.73 HRH3 (0.34) HRH3L3MBTL3CHRM2
SCHEMBL22211328 0.73 HRH3 (0.34) HRH3L3MBTL3CHRM2
SCHEMBL22211364 0.73 HRH3 (0.34) HRH3L3MBTL3CHRM2
SCHEMBL12143914 0.72
SCHEMBL17888356 0.71 HRH3 (0.46) 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-3331886-B1 DOPAMINE D3 RECEPTOR ANTAGONISTS HAVING A BICYCLO MOIETY INDIVIOR UK LTD (GB) 2020-07-15 EP disclosed