SCHEMBL8129014

SCHEMBL8129014

OC(CBr)c1cc(Br)no1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 6/20 0.40
ADRB1 P08588 6/20 0.40
ADRB3 P13945 5/20 0.40

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
SCHEMBL6074317 1.00 ADRB2 (0.40) ADRB2ADRB1ADRB3
SCHEMBL8879834 0.83 ADRB2 (0.44) ADRB2ADRB1ADRB3
SCHEMBL6074550 0.83 ADRB2 (0.39) ADRB2ADRB1ADRB3
SCHEMBL10341872 0.80 ADRB2 (0.45) ADRB2ADRB1ADRB3
SCHEMBL8684187 0.77 ALDH1A1 (0.40)
SCHEMBL8135825 0.76 MME (0.33) ADRB2ADRB1ADRB3
SCHEMBL4538650 0.76 ADRB2 (0.54) ADRB2ADRB1ADRB3
Broxaterol SCHEMBL82745 0.75 ADRB2 (0.46) ADRB2ADRB1ADRB3
SCHEMBL8557552 0.72 ADRB2 (0.32) ADRB2ADRB1ADRB3
SCHEMBL8557911 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4520200-A CHEMICAL INTERMEDIATES FOR BRONCHODILATOR AGENT ZAMBON S.P.A. (IT) 1985-05-28 US claimed
EP-0016255-B1 ISOXAZOLE DERIVATIVE, PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME ZAMBON S.p.A. (IT) 1983-09-28 EP claimed
EP-0016255-A2 Isoxazole derivative, preparation thereof and pharmaceutical compositions containing the same ZAMBON S.p.A. (IT) 1980-10-01 EP claimed
EP-0853619-B1 DISUBSTITUTED PIPERIDINE DERIVATIVES PHARMACIA & UPJOHN SPA (IT) 2000-11-02 EP disclosed
US-5968955-A NEUROPROTECTIVE ACTIVITY AND CNS DISEASE PHARMACIA & UPJOHN S.P.A. (IT) 1999-10-19 US disclosed
EP-0853619-A1 DISUBSTITUTED PIPERIDINE DERIVATIVES PHARMACIA & UPJOHN S.p.A. (IT) 1998-07-22 EP disclosed
WO-1997013769-A1 DISUBSTITUTED PIPERIDINE DERIVATIVES PHARMACIA & UPJOHN S.P.A. (IT) 1997-04-17 WO disclosed
US-4520200-A CHEMICAL INTERMEDIATES FOR BRONCHODILATOR AGENT ZAMBON S.P.A. (IT) 1985-05-28 US disclosed
EP-0016255-B1 ISOXAZOLE DERIVATIVE, PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME ZAMBON S.p.A. (IT) 1983-09-28 EP disclosed
US-4276299-A BRONCHODILATOR AGENTS ZAMBON S.P.A. (IT) 1981-06-30 US disclosed
EP-0016255-A2 Isoxazole derivative, preparation thereof and pharmaceutical compositions containing the same ZAMBON S.p.A. (IT) 1980-10-01 EP disclosed