SCHEMBL30572369

SCHEMBL30572369

CC[C@H](C)[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C)[C@@H](C)CC

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 8/20 0.52
▸ NPY1R P25929 5/20 0.52
▸ NPY2R P49146 4/20 0.52
▸ NPY5R Q15761 4/20 0.52
▸ F2 P00734 2/20 0.52
▸ VIPR2 P41587 3/20 0.51
▸ VIPR1 P32241 3/20 0.51
▸ CTSD P07339 4/20 0.51
▸ TFPI P10646 1/20 0.49

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
SCHEMBL30542168 0.91 NPY4R (0.58) NPY4RNPY1RNPY2RNPY5RF2
SCHEMBL29608079 0.90 KISS1R (0.57) NPY4RNPY1RNPY2RNPY5R
SCHEMBL31514354 0.90 RXFP1 (0.46) NPY4RNPY1RNPY2RNPY5RVIPR2
SCHEMBL31307250 0.90 VIPR2 (0.57) NPY4RNPY1RNPY2RNPY5RVIPR2
SCHEMBL30938822 0.89 F2 (0.50) NPY4RNPY1RNPY2RNPY5RF2
SCHEMBL31005900 0.89 BACE1 (0.59) NPY4RVIPR2VIPR1CTSD
SCHEMBL30827583 0.89 NPY4R (0.59) NPY4RNPY1RNPY2RNPY5RVIPR1
SCHEMBL31473355 0.88 NPY4R (0.61) NPY4RNPY1RNPY2RNPY5RCTSD
SCHEMBL30371577 0.88 TFPI (0.53) NPY4RNPY1RNPY2RNPY5RVIPR2
SCHEMBL29770014 0.87 NPY4R (0.69) NPY4RNPY1RNPY2RNPY5RF2

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-116808282-A Composite double-network hydrogel, preparation method and application 湖南科技学院 2023-09-29 — — CN disclosed
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