SCHEMBL14563136

SCHEMBL14563136

O=C(Nc1ccc(Oc2ccc3c(c2)CCN(C2CCC2)CC3)nc1)OC1CCOCC1

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 20/20 0.73
HRH1 P35367 2/20 0.56

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
SCHEMBL10251674 0.89 HRH3 (0.74) HRH3HRH1
SCHEMBL3094858 0.87 HRH3 (0.74) HRH3HRH1
SCHEMBL14563216 0.85 HRH3 (0.77) HRH3HRH1
SCHEMBL3087316 0.85 HRH3 (1.00) HRH3HRH1
SCHEMBL3091175 0.83 HRH3 (0.79) HRH3HRH1
SCHEMBL3081558 0.82 HRH3 (0.78) HRH3HRH1
SCHEMBL3089524 0.82 HRH3 (0.81) HRH3HRH1
SCHEMBL3100428 0.80 HRH3 (0.74) HRH3HRH1
SCHEMBL3089677 0.79 HRH3 (0.86) HRH3HRH1
SCHEMBL3090975 0.77 HRH3 (0.83) HRH3HRH1

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-2133340-B1 Novel benzazepine derivatives GLAXO GROUP LTD (GB) 2013-01-16 EP claimed