SCHEMBL9015345

SCHEMBL9015345

COc1ccc(C(Cc2ccccc2)NCC(O)COc2ccccc2O)cc1OC

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 19/20 0.60
ADRB2 P07550 11/20 0.60
ADRB1 P08588 8/20 0.60

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
SCHEMBL9027131 1.00 ADRB3 (0.60) ADRB3ADRB2ADRB1
SCHEMBL9015350 0.90 ADRB3 (0.55) ADRB3ADRB2ADRB1
SCHEMBL9015366 0.89 ADRB3 (0.59) ADRB3ADRB2ADRB1
SCHEMBL9026756 0.88 ADRB3 (0.54) ADRB3ADRB2ADRB1
SCHEMBL9015351 0.87 ADRB3 (0.57) ADRB3ADRB2ADRB1
SCHEMBL9015365 0.87 ADRB3 (0.57) ADRB3ADRB2ADRB1
SCHEMBL9015383 0.86 ADRB3 (0.52) ADRB3ADRB2ADRB1
SCHEMBL9015347 0.86 ADRB3 (0.58) ADRB3ADRB2ADRB1
SCHEMBL9015389 0.86 ADRB3 (0.54) ADRB3ADRB2ADRB1
SCHEMBL9015384 0.86 ADRB3 (0.54) ADRB3ADRB2ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5541204-A Aryloxypropanolamine β 3 adrenergic agonists BRISTOL-MYERS SQUIBB COMPANY (US) 1996-07-30 US disclosed