SCHEMBL29689801

SCHEMBL29689801

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

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 11/20 0.44
▸ NPY1R P25929 6/20 0.44
▸ NPY2R P49146 4/20 0.44
▸ NPY5R Q15761 4/20 0.44
▸ NOD1 Q9Y239 1/20 0.39
▸ ENPEP Q07075 5/20 0.39
▸ CTSD P07339 1/20 0.38
▸ BACE1 P56817 1/20 0.38
▸ DPP7 Q9UHL4 1/20 0.38

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
SCHEMBL30786591 0.93 NPY4R (0.48) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL29732406 0.91 NPY4R (0.51) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL30339921 0.91 NPY4R (0.51) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL30456880 0.91 NPY4R (0.51) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL1527412 0.91 NPY4R (0.51) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL30945400 0.91 NPY4R (0.51) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL30305284 0.91 NPY4R (0.51) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL1527410 0.91 NPY4R (0.51) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL30945410 0.91 NPY4R (0.51) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL29732676 0.91 NPY4R (0.51) NPY4RNPY1RNPY2RNPY5RNOD1

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
EP-4007592-A1 ANGIOTENSIN TYPE 2 (AT2) RECEPTOR AGONISTS FOR USE IN THE TREATMENT OF CANCER LanthioPep B.V. (NL) 2022-06-08 — — EP disclosed
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