SCHEMBL31507728

SCHEMBL31507728

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NTSR2 O95665 3/20 0.68
▸ NTSR1 P30989 3/20 0.68
▸ SORT1 Q99523 3/20 0.68
▸ DPP3 Q9NY33 5/20 0.63
▸ TACR1 P25103 1/20 0.57
▸ KISS1R Q969F8 4/20 0.57
▸ CAPN1 P07384 2/20 0.55
▸ CTSB P07858 2/20 0.55
▸ C5AR1 P21730 1/20 0.53
▸ OPRM1 P35372 1/20 0.53
▸ OPRK1 P41145 1/20 0.52

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
SCHEMBL30007955 0.93 NTSR2 (0.65) NTSR2NTSR1SORT1DPP3TACR1
SCHEMBL30518127 0.92 NTSR2 (0.69) NTSR2NTSR1SORT1DPP3TACR1
SCHEMBL30288110 0.91 KISS1R (0.61) NTSR2NTSR1SORT1DPP3KISS1R
SCHEMBL30288104 0.91 DPP3 (0.71) NTSR2NTSR1SORT1DPP3KISS1R
SCHEMBL30414398 0.89 NTSR2 (0.61) NTSR2NTSR1SORT1TACR1KISS1R
SCHEMBL31255250 0.89 NTSR2 (0.63) NTSR2NTSR1SORT1KISS1RCAPN1
SCHEMBL30140869 0.88 F13A1 (0.64) NTSR2NTSR1SORT1DPP3TACR1
SCHEMBL29716634 0.88 NTSR2 (0.75) NTSR2NTSR1SORT1DPP3TACR1
SCHEMBL34470399 0.87 NTSR2 (0.66) NTSR2NTSR1SORT1DPP3TACR1
SCHEMBL31242543 0.87 NTSR2 (0.60) NTSR2NTSR1SORT1TACR1KISS1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120004977-A Polypeptide with angiotensin converting enzyme inhibitory activity and application thereof 西北大学 2025-05-16 — — CN claimed
CN-120004977-B Polypeptide with angiotensin converting enzyme inhibitory activity and application thereof 西北大学 2025-12-23 — — CN disclosed
CN-120004977-A Polypeptide with angiotensin converting enzyme inhibitory activity and application thereof 西北大学 2025-05-16 — — CN disclosed
CN-120004977-A Polypeptide with angiotensin converting enzyme inhibitory activity and application thereof 西北大学 2025-05-16 — — CN disclosed
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