SCHEMBL11213355

SCHEMBL11213355

CCOCC(=O)NCCCOc1cccc(CN2CCCCC2)c1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 2/20 0.78
HRH3 Q9Y5N1 1/20 0.78

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
SCHEMBL11175225 0.92 HRH2 (0.75) HRH2HRH3
SCHEMBL11179648 0.90 HRH2 (0.81) HRH2HRH3
SCHEMBL11382800 0.89 HRH2 (0.77) HRH2HRH3
SCHEMBL11143532 0.89 HRH2 (0.74) HRH2HRH3
SCHEMBL11302925 0.89 HRH2 (0.79) HRH2HRH3
SCHEMBL11176775 0.88 HRH2 (0.82) HRH2HRH3
Roxatidine Acetate SCHEMBL1393 0.88 HRH2 (1.00) HRH2HRH3
SCHEMBL11399763 0.88 HRH2 (1.00) HRH2HRH3
Roxatidine Acetate SCHEMBL29965995 0.88 HRH2 (1.00) HRH2HRH3
SCHEMBL11185887 0.88 HRH2 (0.78) HRH2HRH3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0024510-B1 PHENOXYPROPYL AMINE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM TEIKOKU HORMONE MFG. CO., LTD. (JP) 1983-10-19 EP disclosed
US-4293557-A AMIDES TEIKOKU HORMONE MFG. CO., LTD. (JP) 1981-10-06 US disclosed
EP-0024510-A1 Phenoxypropyl amine derivatives, process for their preparation, and pharmaceutical compositions containing them TEIKOKU HORMONE MFG. CO., LTD. (JP) 1981-03-11 EP disclosed