SCHEMBL20636588

SCHEMBL20636588

COc1c2ccc(Br)cc2nn1C(C)C(N)C#N

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MPO P05164 2/20 0.41
▸ PDE10A Q9Y233 1/20 0.33

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
SCHEMBL20636587 0.74 MPO (0.40) MPOPDE10A
SCHEMBL202847 0.70 MPO (0.38) MPOPDE10A
SCHEMBL16596064 0.64 RET (0.36) MPOPDE10A
SCHEMBL203140 0.62 HPGD (0.42) MPO
SCHEMBL27359756 0.60 PDE10A (0.38) MPOPDE10A
SCHEMBL27167495 0.60 HTT (0.37) MPOPDE10A
SCHEMBL26266060 0.58 MPO (0.43) MPO
SCHEMBL27889426 0.58 PRNP (0.41) MPO
SCHEMBL17839887 0.57 NLRP3 (0.39) PDE10A
SCHEMBL30258631 0.56 PDGFRA (0.35) PDE10A

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
EP-3428148-A1 ARYLOAZOL-2-YL CYANOETHYLAMINO COMPOUNDS, METHOD OF MAKING AND METHOD OF USING THEREOF Merial, Inc. (US) 2019-01-16 — — EP disclosed
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