SCHEMBL3697691

SCHEMBL3697691

Oc1ccc2c(c1)C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)CC2

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 12/20 0.70
ADRB1 P08588 2/20 0.69

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
SCHEMBL8829602 1.00 ADRB3 (0.70) ADRB3ADRB1
SCHEMBL9483243 1.00 ADRB3 (0.70) ADRB3ADRB1
SCHEMBL6133378 1.00 ADRB3 (0.70) ADRB3ADRB1
SCHEMBL9006797 1.00 ADRB3 (0.70) ADRB3ADRB1
SCHEMBL5188566 1.00 ADRB3 (0.70) ADRB3ADRB1
SCHEMBL9006647 1.00 ADRB3 (0.70) ADRB3ADRB1
Hydrochloric Acid SCHEMBL9317513 0.99 ADRB3 (0.69) ADRB3ADRB1
Hydrochloric Acid SCHEMBL10799438 0.99 ADRB3 (0.69) ADRB3ADRB1
Bromide SCHEMBL10800802 0.99 ADRB3 (0.69) ADRB3ADRB1
Hydrochloric Acid SCHEMBL9316504 0.99 ADRB3 (0.69) 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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0403360-B1 Use of phenylethanolamines for the preparation of a medicament for treating ophthalmologic disorders SANOFI SA (FR) 1996-10-16 EP claimed
EP-0303546-B1 O-alkylation process for N-(hydroxy)aralkyl phenyl ethanol amines SANOFI SA (FR) 1994-12-28 EP claimed
US-20100009934-A1 BETA ADRENERGIC RECEPTOR AGONISTS FOR THE TREATMENT OF B-CELL PROLIFERATIVE DISORDERS COMBINATORX, INCORPORATED (US) 2010-01-14 US disclosed
US-20050090669-A1 Aminoalcohol derivatives as beta-3 adrenergic receptor agonists ASTELLAS PHARMA INC. (JP) 2005-04-28 US disclosed
EP-1483236-A1 AMINOALCOHOL DERIVATIVES AS BETA-3 ADRENERGIC RECEPTOR AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-12-08 EP disclosed
WO-2003076397-A1 AMINOALCOHOL DERIVATIVES AS BETA-3 ADRENERGIC RECEPTOR AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-09-18 WO disclosed
EP-0403360-B1 Use of phenylethanolamines for the preparation of a medicament for treating ophthalmologic disorders SANOFI SA (FR) 1996-10-16 EP disclosed
EP-0303546-B1 O-alkylation process for N-(hydroxy)aralkyl phenyl ethanol amines SANOFI SA (FR) 1994-12-28 EP disclosed
EP-0303545-B1 PROCESS FOR THE PREPARATION OF PHENYLETHANOLAMINOTETRALINES ELF SANOFI (FR) 1992-06-17 EP disclosed
EP-0303546-A2 O-alkylation process for N-(hydroxy)aralkyl phenyl ethanol amines SANOFI (FR) 1989-02-15 EP disclosed
EP-0303545-A2 Process for the preparation of phenylethanolaminotetralines ELF SANOFI (FR) 1989-02-15 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100009934-A1 BETA ADRENERGIC RECEPTOR AGONISTS FOR THE TREATMENT OF B-CELL PROLIFERATIVE DISORDERS ADRB1, ADRB2, ADRA2B ADRB3 5/4885ADRB1 1/4885
US-20050090669-A1 Aminoalcohol derivatives as beta-3 adrenergic receptor agonists ADRB2, ADRB1, ADRB3 ADRB3 3/4885ADRB1 2/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.