SCHEMBL8765874

SCHEMBL8765874

O[C@@H](CN[C@H]1CCCc2ccc(Br)cc2C1)c1cccc(Cl)c1

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 15/20 0.65
ADRB1 P08588 3/20 0.65

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
SCHEMBL8765883 1.00 ADRB3 (0.65) ADRB3ADRB1
SCHEMBL8765973 0.89 ADRB3 (0.67) ADRB3ADRB1
SCHEMBL8765968 0.89 ADRB3 (0.67) ADRB3ADRB1
Hydrochloric Acid SCHEMBL5145535 0.84 ADRB3 (0.71) ADRB3ADRB1
SCHEMBL9483243 0.83 ADRB3 (0.70) ADRB3ADRB1
SCHEMBL6133378 0.83 ADRB3 (0.70) ADRB3ADRB1
SCHEMBL5188566 0.83 ADRB3 (0.70) ADRB3ADRB1
SCHEMBL9006647 0.83 ADRB3 (0.70) ADRB3ADRB1
SCHEMBL9006797 0.83 ADRB3 (0.70) ADRB3ADRB1
SCHEMBL8829602 0.83 ADRB3 (0.70) ADRB3ADRB1

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-0583485-B1 ETHANOLAMINE DERIVATIVES HAVING SYMPATHOMIMETIC AND ANTI-POLLAKIURIA ACTIVITIES FUJISAWA PHARMACEUTICAL CO (JP) 1997-08-13 EP disclosed
US-5387710-A Ethanolamine derivatives having sympathomimetic and anti-pollakiuria activities FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-02-07 US disclosed
WO-1993015041-A1 ETHANOLAMINE DERIVATIVES HAVING SYMPATHOMIMETIC AND ANTI-POLLAKIURIA ACTIVITIES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-08-05 WO disclosed