SCHEMBL30087281

SCHEMBL30087281

CC(C)[C@H](NC(=O)CNC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 3/20 0.44
▸ NPY4R P50391 11/20 0.42
▸ NPY1R P25929 6/20 0.42
▸ NPY2R P49146 4/20 0.42
▸ NPY5R Q15761 4/20 0.42
▸ FURIN P09958 3/20 0.37
▸ FNTA P49354 1/20 0.37
▸ FNTB P49356 1/20 0.37
▸ PGGT1B P53609 1/20 0.37
▸ NRP1 O14786 1/20 0.37

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
SCHEMBL31031459 0.92 NOD1 (0.42) NOD1NPY4RNPY1RNPY2RNPY5R
SCHEMBL30774293 0.91 EPHX2 (0.38) NOD1NPY4RNPY1RNPY2RNPY5R
SCHEMBL30198545 0.90 TFPI (0.45) NPY4RNPY1RNPY2RNPY5RFURIN
SCHEMBL30786591 0.90 NPY4R (0.48) NOD1NPY4RNPY1RNPY2RNPY5R
SCHEMBL27632326 0.89 NOD1 (0.51) NOD1NPY4RNPY1RNPY2RNPY5R
SCHEMBL27632323 0.89 NOD1 (0.51) NOD1NPY4RNPY1RNPY2RNPY5R
SCHEMBL11206495 0.88 NPY4R (0.54) NPY4RNPY1RNPY2RNPY5R
SCHEMBL11206486 0.88 NPY4R (0.54) NPY4RNPY1RNPY2RNPY5R
SCHEMBL6850341 0.88 FURIN (0.40) NOD1NPY4RNPY1RNPY2RNPY5R
SCHEMBL6850333 0.88 FURIN (0.40) NOD1NPY4RNPY1RNPY2RNPY5R

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
EP-4355373-A1 COMPOSITION AND USE OF SIRNAS AGAINST VEGFR2 AND TGF-BETA1 IN COMBINATION THERAPY FOR CANCER Sirnaomics, Inc. (US) 2024-04-24 — — EP disclosed
WO-2023288141-A1 COMPOSITION AND USE OF SIRNAS AGAINST VEGFR2 AND TGF-BETA1 IN COMBINATION THERAPY FOR CANCER SIRNAOMICS, INC. (US) 2023-01-19 — — WO disclosed
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