SCHEMBL30853669

SCHEMBL30853669

CC(C)(C)[C@H](N)C(=O)N[C@H](C(=O)O)C(C)(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 1/20 0.52
▸ CA2 P00918 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ PTGS1 P23219 1/20 0.40
▸ SLC7A5 Q01650 1/20 0.34
▸ MMP3 P08254 11/20 0.33
▸ MMP2 P08253 10/20 0.33
▸ MMP1 P03956 9/20 0.33
▸ MMP7 P09237 3/20 0.33
▸ PDF Q9HBH1 2/20 0.33
▸ ARG1 P05089 1/20 0.33
▸ MMP9 P14780 6/20 0.32
▸ MMP8 P22894 4/20 0.32
▸ MMP13 P45452 3/20 0.32
▸ PYGL P06737 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ MMP14 P50281 2/20 0.31
▸ ADAM17 P78536 2/20 0.31
▸ MMP20 O60882 1/20 0.31

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
SCHEMBL29360299 0.83 DPP4 (0.45) DPP4CA2ALDH1A1MAPTPTGS1
SCHEMBL31074245 0.79 DPP4 (0.45) DPP4CA2MMP3MMP2MMP1
SCHEMBL27502709 0.77 PTGS1 (0.47) CA2ALDH1A1MAPTPTGS1MMP3
SCHEMBL29376144 0.76 ALDH1A1 (0.57) DPP4CA2ALDH1A1MAPTPTGS1
SCHEMBL27501940 0.76 SLC7A5 (0.52) SLC7A5MMP3MMP2MMP1MMP7
SCHEMBL7049300 0.76 SLC7A5 (0.52) SLC7A5MMP3MMP2MMP1MMP7
SCHEMBL4127016 0.76 DPP4 (0.62) DPP4CA2ALDH1A1MAPTPTGS1
SCHEMBL7526611 0.76 CA2 (0.45) DPP4CA2ALDH1A1MAPTPTGS1
SCHEMBL27924591 0.76 CA2 (0.45) DPP4CA2ALDH1A1MAPTPTGS1
SCHEMBL3790653 0.76 CA2 (0.45) DPP4CA2ALDH1A1MAPTPTGS1

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
EP-4650362-A1 NEUROPROTECTIVE PSD-95 POLYPEPTIDE INHIBITOR AND USE THEREOF Beijing Tuo Jie Biopharmaceutical Co. Ltd. (CN) 2025-11-19 — — EP claimed
WO-2024149230-A1 NEUROPROTECTIVE PSD-95 POLYPEPTIDE INHIBITOR AND USE THEREOF 北京拓界生物医药科技有限公司 2024-07-18 — — WO claimed
WO-2026012336-A1 PHARMACEUTICALLY ACCEPTABLE SALT OF PSD-95 POLYPEPTIDE INHIBITOR AND PREPARATION METHOD THEREFOR 福建盛迪医药有限公司 2026-01-15 — — WO disclosed
EP-4650362-A1 NEUROPROTECTIVE PSD-95 POLYPEPTIDE INHIBITOR AND USE THEREOF Beijing Tuo Jie Biopharmaceutical Co. Ltd. (CN) 2025-11-19 — — EP disclosed
WO-2024149230-A1 NEUROPROTECTIVE PSD-95 POLYPEPTIDE INHIBITOR AND USE THEREOF 北京拓界生物医药科技有限公司 2024-07-18 — — WO disclosed
US-20240109937-A1 BINDING PEPTIDES AND USES THEREOF THE JOHNS HOPKINS UNIVERSITY 2024-04-04 — — US disclosed
Send feedback