SCHEMBL31410834

SCHEMBL31410834

CC(C)[C@H](NC(=O)CN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 10/20 0.55
▸ NPY5R Q15761 8/20 0.55
▸ NPY1R P25929 7/20 0.55
▸ TFPI P10646 1/20 0.52
▸ NPY2R P49146 5/20 0.51
▸ VIPR1 P32241 1/20 0.49
▸ IL23R Q5VWK5 4/20 0.49
▸ GLP1R P43220 1/20 0.48
▸ GCGR P47871 1/20 0.48
▸ GIPR P48546 1/20 0.48

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
SCHEMBL31410873 0.90 TFPI (0.59) NPY4RNPY5RNPY1RTFPINPY2R
SCHEMBL29550386 0.86 TFPI (0.59) NPY4RNPY5RNPY1RTFPIVIPR1
SCHEMBL30771537 0.86 TFPI (0.59) NPY4RNPY5RNPY1RTFPIVIPR1
SCHEMBL29939606 0.86 NPY4R (0.59) NPY4RNPY5RNPY1RTFPINPY2R
SCHEMBL29700033 0.86 NPY4R (0.54) NPY4RNPY5RNPY1RTFPINPY2R
SCHEMBL30176472 0.86 VIPR1 (0.61) NPY4RNPY5RNPY1RTFPINPY2R
SCHEMBL31307283 0.86 NPY4R (0.59) NPY4RNPY5RNPY1RNPY2R
SCHEMBL29689104 0.85 TFPI (0.52) NPY4RNPY5RNPY1RTFPIVIPR1
SCHEMBL8997940 0.85 TFPI (0.66) TFPIVIPR1GLP1RGCGRGIPR
SCHEMBL8998005 0.85 TFPI (0.66) TFPIVIPR1GLP1RGCGRGIPR

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-2025002589-A1 TISSUE EXTRACELLULAR PEPTIDE PATTERNS DEDICATED FOR GENERATION OF ANTI-CANCER VACCINES AGAINST SALIVARY GLAND TUMOR, IDENTIFICATION AND ISOLATION OF SALIVARY GLAND TUMOR SPECIFIC T CELLS IN HUMANS Uniwersytet Gdański (PL) 2025-01-02 — — WO claimed
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