SCHEMBL31353030

SCHEMBL31353030

CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 7/20 0.57
NPY1R P25929 6/20 0.57
NPY2R P49146 3/20 0.57
BACE1 P56817 3/20 0.55
BACE2 Q9Y5Z0 2/20 0.55
NPY5R Q15761 5/20 0.51
TFPI P10646 1/20 0.49
IL1RN P18510 1/20 0.49
ERAP2 Q6P179 1/20 0.49
PTPN1 P18031 1/20 0.49
KISS1R Q969F8 4/20 0.48
NPBWR1 P48145 2/20 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
SCHEMBL31433273 0.91 BACE1 (0.59) NPY4RNPY1RNPY2RBACE1BACE2
SCHEMBL29679856 0.91 NPY1R (0.58) NPY4RNPY1RNPY2RBACE1BACE2
SCHEMBL30320569 0.91 BACE1 (0.58) BACE1BACE2TFPIKISS1R
SCHEMBL29385779 0.90 NPY4R (0.61) NPY4RNPY1RNPY2RBACE1BACE2
SCHEMBL31506753 0.90 BACE1 (0.55) NPY4RNPY1RNPY2RBACE1BACE2
SCHEMBL32664291 0.90 NPY4R (0.65) NPY4RNPY1RNPY2RBACE1BACE2
SCHEMBL32677746 0.90 BACE1 (0.59) NPY4RNPY1RNPY2RBACE1BACE2
SCHEMBL30647291 0.90 BACE1 (0.59) NPY4RNPY1RNPY2RBACE1BACE2
SCHEMBL30607418 0.89 BACE1 (0.60) NPY4RNPY1RNPY2RBACE1BACE2
SCHEMBL30721576 0.89 TFPI (0.61) TFPINPBWR1

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
CN-119390763-A Characteristic peptide segment for identifying antelope horn and detection method thereof 南京中医药大学 2025-02-07 CN claimed
CN-119390763-A Characteristic peptide segment for identifying antelope horn and detection method thereof 南京中医药大学 2025-02-07 CN disclosed
CN-119390763-A Characteristic peptide segment for identifying antelope horn and detection method thereof 南京中医药大学 2025-02-07 CN disclosed