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Sugi Predict / Compounds / SCHEMBL30198545

SCHEMBL30198545

SCHEMBL30198545

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

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TFPI P10646 1/20 0.45
▸ RXFP1 Q9HBX9 1/20 0.44
▸ NPY4R P50391 5/20 0.42
▸ NPY1R P25929 4/20 0.42
▸ NPY2R P49146 4/20 0.42
▸ NPY5R Q15761 4/20 0.42
▸ FURIN P09958 3/20 0.41
▸ IL23R Q5VWK5 3/20 0.41
▸ PRSS1 P07477 1/20 0.41

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
SCHEMBL30844336 0.90 RXFP1 (0.54) TFPIRXFP1IL23R
SCHEMBL30087281 0.90 NOD1 (0.44) NPY4RNPY1RNPY2RNPY5RFURIN
SCHEMBL31257159 0.90 TFPI (0.44) TFPIRXFP1NPY4RNPY1RNPY2R
SCHEMBL5046591 0.88 NOD1 (0.44) TFPIRXFP1NPY4RNPY1RNPY2R
SCHEMBL30486089 0.88 NPY4R (0.49) NPY4RNPY1RNPY2RNPY5RFURIN
SCHEMBL8010124 0.88 NPY4R (0.45) NPY4RNPY1RNPY2RNPY5R
SCHEMBL8010129 0.88 NPY4R (0.45) NPY4RNPY1RNPY2RNPY5R
SCHEMBL30121023 0.88 NOD1 (0.47) NPY4RNPY1RNPY2RNPY5R
SCHEMBL31047157 0.87 FOLH1 (0.48) TFPINPY4RNPY1RNPY2RNPY5R
SCHEMBL6256584 0.87 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5R

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-11566256-B2 Polynucleotides and polypeptides in plants MENDEL BIOTECHNOLOGY, INC. (US) 2023-01-31 — — US disclosed
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