SCHEMBL29625203

SCHEMBL29625203

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

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 13/20 0.56
▸ NPY1R P25929 7/20 0.56
▸ NPY2R P49146 5/20 0.56
▸ NPY5R Q15761 5/20 0.56
▸ OPRD1 P41143 3/20 0.55
▸ KISS1R Q969F8 2/20 0.47
▸ BACE1 P56817 1/20 0.47
▸ BACE2 Q9Y5Z0 1/20 0.47

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
SCHEMBL29839246 0.95 NPY4R (0.59) NPY4RNPY1RNPY2RNPY5ROPRD1
SCHEMBL30496421 0.92 NPY4R (0.59) NPY4RNPY1RNPY2RNPY5ROPRD1
SCHEMBL30918767 0.92 NPY4R (0.57) NPY4RNPY1RNPY2RNPY5ROPRD1
SCHEMBL29649734 0.90 NPY4R (0.61) NPY4RNPY1RNPY2RNPY5ROPRD1
SCHEMBL30331385 0.90 NPY4R (0.61) NPY4RNPY1RNPY2RNPY5ROPRD1
SCHEMBL29649760 0.90 NPY4R (0.61) NPY4RNPY1RNPY2RNPY5ROPRD1
SCHEMBL29559026 0.90 NPY4R (0.60) NPY4RNPY1RNPY2RNPY5ROPRD1
SCHEMBL29839266 0.89 NPY4R (0.58) NPY4RNPY1RNPY2RNPY5ROPRD1
SCHEMBL30918766 0.89 NPY4R (0.61) NPY4RNPY1RNPY2RNPY5ROPRD1
SCHEMBL31233596 0.89 NPY4R (0.60) NPY4RNPY1RNPY2RNPY5RBACE1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220257698-A1 ANGIOTENSIN TYPE 2 (AT2) RECEPTOR AGONISTS FOR USE IN THE TREATMENT OF CANCER LANTHIOPEP B.V. (NL) 2022-08-18 — — US disclosed
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
CN-114514032-A Angiotensin type 2 (AT2) receptor agonists for the treatment of cancer 兰提欧派普有限公司 2022-05-17 — — CN disclosed
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