SCHEMBL5213872

SCHEMBL5213872

CC(C)N1CCC(OC2CCN(c3cnc(C(=O)NC4CCC4)cn3)CC2)CC1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 15/20 0.57
ACKR3 P25106 1/20 0.44

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
SCHEMBL5210303 0.89 HRH3 (0.57) HRH3
SCHEMBL5209262 0.87 HRH3 (0.57) HRH3
SCHEMBL5212822 0.85 ACKR3 (0.46) HRH3ACKR3
SCHEMBL5209064 0.84 HRH3 (0.52) HRH3
SCHEMBL5210417 0.84 HRH3 (0.56) HRH3ACKR3
SCHEMBL5212146 0.84 HRH3 (0.54) HRH3
SCHEMBL5212115 0.82 HRH3 (0.56) HRH3ACKR3
Hydrochloric Acid SCHEMBL5208971 0.81 HRH3 (0.58) HRH3
SCHEMBL5213075 0.79 HRH3 (0.46) HRH3
SCHEMBL4034064 0.78 HRH3 (0.51) 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-1646620-B1 SUBSTITUTED PIPERIDINES AS HISTAMINE H3 RECEPTOR LIGANDS GLAXO GROUP LTD (GB) 2007-08-15 EP claimed