SCHEMBL30475514

SCHEMBL30475514

CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 16/20 0.45
▸ FNTB P49356 16/20 0.45
▸ PGGT1B P53609 14/20 0.45
▸ NPY1R P25929 1/20 0.37
▸ NPY2R P49146 1/20 0.37
▸ NPY4R P50391 1/20 0.37
▸ NPY5R Q15761 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
SCHEMBL30173158 0.91 ENPEP (0.41) FNTAFNTBPGGT1B
SCHEMBL30563214 0.89 NOD1 (0.40) NPY1RNPY2RNPY4RNPY5R
SCHEMBL607984 0.89 NOD1 (0.40) NPY1RNPY2RNPY4RNPY5R
SCHEMBL607985 0.89 NOD1 (0.40) NPY1RNPY2RNPY4RNPY5R
SCHEMBL29678580 0.88 TERT (0.42) FNTAFNTBPGGT1BNPY1RNPY2R
SCHEMBL29587324 0.88 ENPEP (0.42) NPY1RNPY2RNPY4RNPY5R
SCHEMBL31127560 0.87 FNTA (0.42) FNTAFNTBPGGT1B
SCHEMBL31412178 0.87 FNTA (0.46) FNTAFNTBPGGT1BNPY1RNPY2R
SCHEMBL8003500 0.85 FNTA (0.46) FNTAFNTBPGGT1BNPY1RNPY2R
SCHEMBL8003506 0.85 FNTA (0.46) FNTAFNTBPGGT1BNPY1RNPY2R

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
CN-113999287-B Galectin-10-targeted polypeptide inhibitor and preparation method and application thereof 深圳湾实验室坪山生物医药研发转化中心 2023-06-27 — — CN disclosed
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