SCHEMBL4792011

SCHEMBL4792011

NC(=O)N(c1ccc2c(c1)CCN(C1CCC1)CC2)c1ccccc1OC(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 19/20 0.42
CYP2D6 P10635 3/20 0.39
HRH1 P35367 1/20 0.35

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
SCHEMBL4792086 0.87 FKBP1A (0.45) HRH3CYP2D6HRH1
SCHEMBL4791232 0.85 HRH3 (0.44) HRH3CYP2D6HRH1
SCHEMBL4775800 0.81 FKBP1A (0.44) HRH3CYP2D6HRH1
SCHEMBL4793933 0.81 HRH3 (0.51) HRH3CYP2D6
SCHEMBL4770320 0.80 HRH3 (0.53) HRH3CYP2D6HRH1
SCHEMBL4771920 0.76 HRH3 (0.42) HRH3CYP2D6
SCHEMBL4766025 0.76 HRH3 (0.44) HRH3CYP2D6HRH1
SCHEMBL4791239 0.76 HRH3 (0.44) HRH3CYP2D6
SCHEMBL4793168 0.76 HRH3 (0.41) HRH3CYP2D6HRH1
SCHEMBL4777033 0.75 HRH3 (0.39) HRH3CYP2D6HRH1

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-1713778-B1 BENZAZEPINE DERIVATIVES AS HISTAMINE H3 ANTAGONISTS GLAXO GROUP LTD (GB) 2008-01-16 EP claimed