SCHEMBL6533340

SCHEMBL6533340

CN1CCN(C(=O)Cc2cccc(CC(C)(C)NCC(O)c3ccc(O)cc3)c2)CC1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 16/20 0.49
ADRB1 P08588 1/20 0.43
ADRB3 P13945 2/20 0.42
POLB P06746 1/20 0.41

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
SCHEMBL6506995 0.97 ADRB2 (0.47) ADRB2ADRB1ADRB3POLB
SCHEMBL6508632 0.92 ADRB2 (0.49) ADRB2ADRB1POLB
SCHEMBL3913331 0.92 ADRB2 (0.47) ADRB2ADRB1ADRB3POLB
SCHEMBL6529084 0.92 ADRB2 (0.51) ADRB2ADRB1POLB
SCHEMBL6509325 0.91 ADRB2 (0.48) ADRB2ADRB1POLB
SCHEMBL3915484 0.90 ADRB2 (0.45) ADRB2ADRB1ADRB3POLB
SCHEMBL6530357 0.89 ADRB2 (0.47) ADRB2ADRB1POLB
SCHEMBL6503586 0.86 ADRB2 (0.48) ADRB2
SCHEMBL6508454 0.85 ADRB2 (0.47) ADRB2ADRB1
SCHEMBL6507412 0.85 KDM4E (0.49) ADRB2POLB

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
WO-2005092841-A1 COMPOUNDS HAVING BETA-AGONIST ACTIVITY PFIZER LIMITED (GB) 2005-10-06 WO disclosed