SCHEMBL9764359

SCHEMBL9764359

CC(=O)Nc1ccc(CCOCCCCCCNCC(O)c2cc(Cl)c(N)c(Cl)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 18/20 0.51
▸ ADRB3 P13945 15/20 0.50
▸ ADRB1 P08588 14/20 0.50
▸ SLC2A1 P11166 1/20 0.49

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
SCHEMBL9764380 0.86 ADRB2 (0.53) ADRB2ADRB3ADRB1SLC2A1
SCHEMBL10467788 0.86 SLC2A1 (0.52) ADRB2ADRB3ADRB1SLC2A1
SCHEMBL9764235 0.86 ADRB2 (0.49) ADRB2ADRB3ADRB1SLC2A1
SCHEMBL9764714 0.85 ADRB2 (0.53) ADRB2ADRB3ADRB1SLC2A1
SCHEMBL9764503 0.84 ADRB2 (0.51) ADRB2ADRB3ADRB1SLC2A1
SCHEMBL9764490 0.84 ADRB2 (0.58) ADRB2ADRB3ADRB1SLC2A1
SCHEMBL9764465 0.84 ADRB2 (0.58) ADRB2ADRB3ADRB1SLC2A1
Hydrochloric Acid SCHEMBL9764518 0.84 ADRB2 (0.52) ADRB2ADRB3ADRB1SLC2A1
SCHEMBL9764317 0.83 ADRB2 (0.50) ADRB2ADRB3ADRB1SLC2A1
SCHEMBL9764346 0.82 SLC2A1 (0.53) ADRB2ADRB3ADRB1SLC2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0181709-B1 DICHLOROANILINE DERIVATIVES GLAXO GROUP LIMITED (GB) 1990-05-09 — — EP claimed
EP-0181709-A1 Dichloroaniline Derivatives GLAXO GROUP LIMITED (GB) 1986-05-21 — — EP claimed
US-5006556-A Dichloroaniline derivatives for the therapy or prophylaxysis of a disease associated with reversible airway obstruction GLAXO GROUP LIMITED (GB) 1991-04-09 — — US disclosed
US-4943591-A TREATMENT OF ASTHMA AND BRONCHITIS GLAXO GROUP LIMITED (GB) 1990-07-24 — — US disclosed
EP-0181709-B1 DICHLOROANILINE DERIVATIVES GLAXO GROUP LIMITED (GB) 1990-05-09 — — EP disclosed
EP-0181709-A1 Dichloroaniline Derivatives GLAXO GROUP LIMITED (GB) 1986-05-21 — — EP disclosed
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