SCHEMBL22788819

SCHEMBL22788819

CN[C@@H](CN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=O)C(C)=O

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NPY5R Q15761 3/20 0.37
▸ NPY1R P25929 2/20 0.37
▸ NPY4R P50391 2/20 0.37
▸ SIRT5 Q9NXA8 3/20 0.36
▸ FURIN P09958 8/20 0.36
▸ SIRT2 Q8IXJ6 2/20 0.34
▸ SIRT6 Q8N6T7 1/20 0.34
▸ SIRT1 Q96EB6 1/20 0.34

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
SCHEMBL22790598 0.89 NPY5R (0.36) NPY5RNPY1RNPY4RSIRT5FURIN
SCHEMBL22788736 0.88 FURIN (0.37) SIRT5FURINSIRT2SIRT6SIRT1
SCHEMBL21103049 0.87 SIRT5 (0.38) NPY5RNPY1RNPY4RSIRT5SIRT2
SCHEMBL20793359 0.85 KISS1R (0.37) NPY5RNPY1RNPY4RSIRT5SIRT2
SCHEMBL22708835 0.83 CACNA1B (0.45) NPY5RNPY1RNPY4RSIRT5
SCHEMBL17860192 0.81 NMT2 (0.40) NPY5RNPY1RNPY4RSIRT5FURIN
SCHEMBL12035295 0.81 SIRT5 (0.46) NPY5RNPY1RNPY4RSIRT5FURIN
SCHEMBL15315075 0.79 C3AR1 (0.38) SIRT5SIRT6SIRT1
SCHEMBL10441955 0.79 C3AR1 (0.38) SIRT5SIRT6SIRT1
SCHEMBL15691795 0.79 C3AR1 (0.38) SIRT5SIRT6SIRT1

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-2020252043-A1 5H-PYRROLO[3,2-d]PYRIMIDINE-2,4-DIAMINO COMPOUNDS AND ANTIBODY CONJUGATES THEREOF SUTRO BIOPHARMA, INC. (US) 2020-12-17 — — WO disclosed
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