SCHEMBL10656363

SCHEMBL10656363

COC(=O)c1ccc(CC(C)NCC(O)c2ccccc2)c(Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ADRB3 P13945 17/20 0.54
▸ ADRB1 P08588 15/20 0.54
▸ ADRB2 P07550 10/20 0.46
▸ ADRA1D P25100 1/20 0.45
▸ ADRA1A P35348 1/20 0.45
▸ ADRA1B P35368 1/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ GLA P06280 1/20 0.45

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
SCHEMBL10665497 0.87 ADRB3 (0.56) ADRB3ADRB1ADRB2
SCHEMBL11041085 0.86 ADRB3 (0.46) ADRB3ADRB1ADRB2ADRA1DADRA1A
SCHEMBL7153666 0.82 ADRB3 (0.77) ADRB3ADRB1ADRB2ADRA1DADRA1A
SCHEMBL10508374 0.82 ADRB3 (0.77) ADRB3ADRB1ADRB2ADRA1DADRA1A
SCHEMBL11172401 0.82 ADRB3 (0.77) ADRB3ADRB1ADRB2ADRA1DADRA1A
SCHEMBL9006725 0.82 ADRB3 (0.77) ADRB3ADRB1ADRB2ADRA1DADRA1A
SCHEMBL11174788 0.82 ADRB3 (0.77) ADRB3ADRB1ADRB2ADRA1DADRA1A
SCHEMBL7153662 0.82 ADRB3 (0.77) ADRB3ADRB1ADRB2ADRA1DADRA1A
SCHEMBL7148551 0.79 ADRB3 (0.53) ADRB3ADRB1ADRB2
SCHEMBL7148552 0.79 ADRB3 (0.53) ADRB3ADRB1ADRB2

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-4753962-A HYPOGLYCEMIC, ANTIOBESITY AGENT BEECHAM GROUP P.L.C. (GB) 1988-06-28 — — US disclosed
US-4654371-A ANTI-OBESITY, HYPOGLYCEMIA AGENTS BEECHAM GROUP P.L.C. (GB) 1987-03-31 — — US disclosed
US-4478849-A HYPERGLYCEMIC AGENTS BEECHAM GROUP LIMITED (GB) 1984-10-23 — — US disclosed
EP-0006735-B1 SECONDARY AMINES, THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE BEECHAM GROUP PLC (GB) 1983-06-15 — — EP disclosed
EP-0006735-A1 Secondary amines, their preparation, pharmaceutical compositions containing them and their use BEECHAM GROUP PLC (GB) 1980-01-09 — — EP disclosed
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