SCHEMBL31346756

SCHEMBL31346756

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

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ VIPR1 P32241 4/20 0.55
▸ VIPR2 P41587 6/20 0.54
▸ KISS1R Q969F8 2/20 0.52
▸ TFPI P10646 1/20 0.52
▸ BACE1 P56817 1/20 0.52
▸ ECE1 P42892 1/20 0.51
▸ GLP1R P43220 1/20 0.51
▸ MUS81 Q96NY9 1/20 0.51
▸ NPY5R Q15761 3/20 0.51
▸ NPY1R P25929 2/20 0.51
▸ NPY4R P50391 2/20 0.51

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
SCHEMBL31182826 0.93 VIPR1 (0.59) VIPR1VIPR2KISS1RTFPIBACE1
SCHEMBL31256941 0.91 BACE1 (0.57) VIPR1VIPR2KISS1RTFPIBACE1
SCHEMBL29489541 0.90 VIPR1 (0.63) VIPR1VIPR2KISS1RTFPIBACE1
SCHEMBL29580062 0.89 VIPR1 (0.63) VIPR1VIPR2KISS1RBACE1NPY5R
SCHEMBL30502848 0.89 BACE1 (0.58) VIPR1VIPR2KISS1RBACE1ECE1
SCHEMBL30578032 0.88 KISS1R (0.62) VIPR1VIPR2KISS1RTFPIECE1
SCHEMBL9401494 0.88 NPY4R (0.62) KISS1RNPY5RNPY1RNPY4R
SCHEMBL30607388 0.87 VIPR1 (0.64) VIPR1VIPR2KISS1RTFPIBACE1
SCHEMBL30974297 0.87 TFPI (0.62) VIPR1VIPR2TFPIGLP1RNPY5R
SCHEMBL29486242 0.87 KISS1R (0.62) VIPR1VIPR2KISS1RTFPIECE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119390762-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-119390762-A Characteristic peptide segment for identifying antelope horn and detection method thereof 南京中医药大学 2025-02-07 — — CN disclosed
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