SCHEMBL18745481

SCHEMBL18745481

C=NCCOB(C)OCCCC

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.31
ADRB1 P08588 1/20 0.31
ADRB3 P13945 1/20 0.31

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
SCHEMBL18745464 0.92 ADRB2 (0.31) ADRB2ADRB1ADRB3
SCHEMBL2177663 0.82 ADRB2 (0.43) ADRB2ADRB1ADRB3
SCHEMBL25565605 0.77 ADRB2 (0.39) ADRB2ADRB1ADRB3
SCHEMBL17150115 0.71 DNM1 (0.42) ADRB2ADRB1ADRB3
SCHEMBL19017281 0.67 TSHR (0.52) ADRB2ADRB1ADRB3
SCHEMBL7796564 0.66
SCHEMBL2873968 0.66
SCHEMBL7796563 0.66
SCHEMBL50476 0.63 ADRB2 (0.45) ADRB2ADRB1ADRB3
SCHEMBL8727179 0.63 ADRB2 (0.45) ADRB2ADRB1ADRB3

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-9624375-B2 Boron containing perylene monoimides, a process for their production, their use as building blocks for the production of perylene monoimide derivatives, monoimide derivatives and their use in dye-sensitized solar cells BASF SE (DE) 2017-04-18 US disclosed