SCHEMBL8402448

SCHEMBL8402448

COC(=O)Cc1ccc(OC[C@@H](C)NC[C@H](O)c2cccc(Cl)c2)cc1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ADRB3 P13945 14/20 0.72
▸ ADRB2 P07550 12/20 0.72
▸ ADRB1 P08588 9/20 0.72
▸ GLA P06280 1/20 0.72
▸ CYP2D6 P10635 2/20 0.64
▸ ADRA1D P25100 1/20 0.64
▸ ADRA1A P35348 1/20 0.64
▸ ADRA1B P35368 1/20 0.64
▸ CYP1A2 P05177 1/20 0.64
▸ CYP2C9 P11712 1/20 0.64
▸ CYP2C19 P33261 1/20 0.64
▸ CYP3A4 P08684 1/20 0.62
▸ HIF1A Q16665 1/20 0.62
▸ SLC2A1 P11166 4/20 0.61

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
SCHEMBL8402067 1.00 ADRB3 (0.72) ADRB3ADRB2ADRB1GLACYP2D6
Fumaric Acid SCHEMBL8406896 0.94 ADRB3 (0.65) ADRB3ADRB2ADRB1GLACYP2D6
Fumaric Acid SCHEMBL8911242 0.94 ADRB3 (0.65) ADRB3ADRB2ADRB1GLACYP2D6
Fumaric Acid SCHEMBL8406993 0.94 ADRB3 (0.65) ADRB3ADRB2ADRB1GLACYP2D6
Fumaric Acid SCHEMBL8406987 0.94 ADRB3 (0.65) ADRB3ADRB2ADRB1GLACYP2D6
SCHEMBL8976358 0.91 ADRB3 (0.71) ADRB3ADRB2ADRB1GLACYP2D6
SCHEMBL8976361 0.91 ADRB3 (0.71) ADRB3ADRB2ADRB1GLACYP2D6
SCHEMBL8402100 0.91 ADRB2 (0.58) ADRB3ADRB2ADRB1GLACYP2D6
SCHEMBL8406644 0.90 ADRB3 (0.69) ADRB3ADRB2ADRB1GLACYP2D6
SCHEMBL8406234 0.89 ADRB2 (0.56) ADRB3ADRB2ADRB1GLACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5977374-A 5-(4-hydroxy-OR 4-acetoxy-benzyl)-3- triphenylmethylthiazolidine-2,4-dione and method for producing same SANKYO COMPANY, LIMITED (JP) 1999-11-02 — — US disclosed
US-5635534-A 1-PHENYL-2-(2-PHENYLOXY OR THIO)-1-METHYLETHYL)AMINOETHANOL DERIVATIVES; ALDOSE REDUCTASE INHIBITORS; NONTOXIC; ANTIDIABETIC,-OBESITY,-LIPEMIC AND HYPOGLYCEMIC AGENTS SANKYO COMPANY, LIMITED (JP) 1997-06-03 — — US disclosed
US-5576340-A Aromatic amino-alcohol derivatives having anti-diabetic and anti-obesity properties, their preparation and their therapeutic uses SANKYO COMPANY, LIMITED (JP) 1996-11-19 — — US disclosed
EP-0543662-B1 Aromatic amino-alcohol derivatives having anti-diabetic and anti-obesity properties, their preparation and their therapeutic uses SANKYO CO (JP) 1996-09-18 — — EP disclosed
EP-0543662-A2 Aromatic amino-alcohol derivatives having anti-diabetic and anti-obesity properties, their preparation and their therapeutic uses Sankyo Company Limited (JP) 1993-05-26 — — EP disclosed
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