Sugi Predict

Sugi Predict / Compounds / SCHEMBL30690100

SCHEMBL30690100

SCHEMBL30690100

CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCSC)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)[C@@H](C)O)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CXCL8 P10145 10/20 0.56
▸ CAPN1 P07384 2/20 0.54
▸ CTSB P07858 2/20 0.54
▸ CXCR4 P61073 2/20 0.54
▸ MC4R P32245 1/20 0.51
▸ MC5R P33032 1/20 0.51
▸ MC3R P41968 1/20 0.51
▸ MC1R Q01726 1/20 0.51
▸ CTSL P07711 2/20 0.51
▸ CTSS P25774 2/20 0.51
▸ CTSK P43235 2/20 0.51
▸ CTSH P09668 1/20 0.51
▸ GLP1R P43220 1/20 0.50
▸ RAMP3 O60896 1/20 0.50
▸ CALCR P30988 1/20 0.50

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
SCHEMBL31247321 0.96 CAPN1 (0.58) CXCL8CAPN1CTSBCXCR4CTSL
SCHEMBL30690107 0.95 CAPN1 (0.59) CXCL8CAPN1CTSBCXCR4
SCHEMBL30690108 0.95 CAPN1 (0.59) CXCL8CAPN1CTSBCXCR4
SCHEMBL31247502 0.95 CXCL8 (0.54) CXCL8CAPN1CTSBCXCR4MC4R
SCHEMBL30690109 0.94 CXCL8 (0.58) CXCL8CAPN1CTSBCXCR4CTSL
SCHEMBL30690087 0.93 CAPN1 (0.57) CXCL8CAPN1CTSBCXCR4
SCHEMBL31247508 0.93 CXCL8 (0.55) CXCL8CAPN1CTSBCTSLCTSS
SCHEMBL30690070 0.92 CAPN1 (0.57) CXCL8CAPN1CTSBCXCR4
SCHEMBL31247492 0.92 CAPN1 (0.63) CXCL8CAPN1CTSBCXCR4CTSL
SCHEMBL31247447 0.92 CAPN1 (0.63) CXCL8CAPN1CTSBCXCR4CTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024235070-A1 PEPTIDE COMPOUND, COMPOSITION AND USE THEREOF 杭州禾泰健宇生物科技有限公司 2024-11-21 — — WO claimed
CN-117903233-A Lysate, application thereof and preparation method of polypeptide 杭州禾泰健宇生物科技有限公司 2024-04-19 — — CN claimed
CN-117247427-A Peptide compound, composition and application thereof 杭州禾泰健宇生物科技有限公司 2023-12-19 — — CN claimed
WO-2024235070-A1 PEPTIDE COMPOUND, COMPOSITION AND USE THEREOF 杭州禾泰健宇生物科技有限公司 2024-11-21 — — WO disclosed
CN-117247427-B Peptide compound, composition and application thereof 杭州禾泰健宇生物科技有限公司 2024-08-23 — — CN disclosed
CN-117903233-A Lysate, application thereof and preparation method of polypeptide 杭州禾泰健宇生物科技有限公司 2024-04-19 — — CN disclosed
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