SCHEMBL30488191

SCHEMBL30488191

CCCNCC(O)c1cccnc1

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 11/20 0.57
ADRB2 P07550 7/20 0.57
ADRB3 P13945 17/20 0.54

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
SCHEMBL25229181 1.00 ADRB1 (0.57) ADRB1ADRB2ADRB3
SCHEMBL30488096 1.00 ADRB1 (0.57) ADRB1ADRB2ADRB3
SCHEMBL30488093 1.00 ADRB1 (0.57) ADRB1ADRB2ADRB3
SCHEMBL25226428 1.00 ADRB1 (0.57) ADRB1ADRB2ADRB3
SCHEMBL4053207 1.00 ADRB1 (0.57) ADRB1ADRB2ADRB3
SCHEMBL20819407 0.91 ADRB1 (0.55) ADRB1ADRB2ADRB3
SCHEMBL26177226 0.84 ADRB3 (0.55) ADRB1ADRB2ADRB3
SCHEMBL11746227 0.84 ADRB1 (0.54) ADRB1ADRB2ADRB3
SCHEMBL6320255 0.80 SLC6A3 (0.55) ADRB1ADRB2ADRB3
SCHEMBL4048311 0.80 SLC6A3 (0.55) ADRB1ADRB2ADRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119031913-A Purine and methods of use thereof 奇尼塔公司 2024-11-26 CN disclosed
WO-2023107630-A2 AMINO ALCOHOL COMPOUNDS AND USES THEREOF Kineta, Inc. (US) 2023-06-15 WO disclosed