SCHEMBL23036809

SCHEMBL23036809

C#CCCC(NC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 11/20 0.49
▸ CTSK P43235 10/20 0.49
▸ CTSL P07711 2/20 0.46
▸ CTSB P07858 2/20 0.46
▸ PPARA Q07869 5/20 0.43
▸ PPARG P37231 4/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ ACE P12821 1/20 0.42
▸ PPARD Q03181 2/20 0.41

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
SCHEMBL8141271 1.00 CTSS (0.49) CTSSCTSKCTSLCTSBPPARA
SCHEMBL23273778 1.00 CTSS (0.49) CTSSCTSKCTSLCTSBPPARA
SCHEMBL28462855 0.91 CTSK (0.51) CTSSCTSKCTSLCTSBPPARA
SCHEMBL28462823 0.91 CTSK (0.51) CTSSCTSKCTSLCTSBPPARA
SCHEMBL4656416 0.91 CTSK (0.51) CTSSCTSKCTSLCTSBPPARA
SCHEMBL21004186 0.86 CTSK (0.45) CTSSCTSKCTSLCTSB
SCHEMBL25166303 0.86 CTSK (0.45) CTSSCTSKCTSLCTSB
SCHEMBL9181378 0.86 CTSS (0.50) CTSSCTSKCTSLCTSBPPARA
SCHEMBL9181382 0.86 CTSS (0.50) CTSSCTSKCTSLCTSBPPARA
SCHEMBL14940839 0.86 CTSS (0.50) CTSSCTSKCTSLCTSBPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112778162-B Preparation method of chiral beta- (Boc-amino) -5-hexynoic acid 上海海皋科技有限公司 2023-06-16 — — CN disclosed
CN-112778162-B Preparation method of chiral beta- (Boc-amino) -5-hexynoic acid 上海海皋科技有限公司 2023-06-16 — — CN disclosed
CN-112778162-B Preparation method of chiral beta- (Boc-amino) -5-hexynoic acid 上海海皋科技有限公司 2023-06-16 — — CN disclosed
US-20210236408-A1 METHOD FOR THE TREATMENT AND/OR PREVENTION OF DAMAGED KERATIN RAVICHANDRAN RANJITHKUMAR (SE) 2021-08-05 — — US disclosed
WO-2021081110-A2 PEPTIDES AND USE THEREOF ANEXIGEN, INC. (US) 2021-04-29 — — WO disclosed
EP-3784208-A1 METHOD FOR THE TREATMENT AND/OR PREVENTION OF DAMAGED KERATIN Sivlér, Petter (SE) 2021-03-03 — — EP disclosed
CN-111777521-A Synthesis method of multi-configuration long-chain phenyl amino acid compound 苏州爱玛特生物科技有限公司 2020-10-16 — — CN disclosed
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