SCHEMBL10908256

SCHEMBL10908256

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

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GABRP O00591 2/20 0.38
▸ GABRD O14764 2/20 0.38
▸ GABRA1 P14867 2/20 0.38
▸ GABRB1 P18505 2/20 0.38
▸ GABRG2 P18507 2/20 0.38
▸ GABRB3 P28472 2/20 0.38
▸ GABRA5 P31644 2/20 0.38
▸ GABRA3 P34903 2/20 0.38
▸ GABRA2 P47869 2/20 0.38
▸ GABRB2 P47870 2/20 0.38
▸ GABRA4 P48169 2/20 0.38
▸ GABRE P78334 2/20 0.38
▸ GABRA6 Q16445 2/20 0.38
▸ GABRG1 Q8N1C3 2/20 0.38
▸ GABRG3 Q99928 2/20 0.38
▸ GABRQ Q9UN88 2/20 0.38
▸ DPP4 P27487 2/20 0.38
▸ DPP9 Q86TI2 1/20 0.38
▸ BHMT Q93088 1/20 0.36
▸ ARG1 P05089 1/20 0.34

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
Hydrochloric Acid SCHEMBL11341606 0.98 DPP4 (0.37) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL29697664 0.85 DPP4 (0.35) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL3338673 0.83 DPP4 (0.56) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL30522084 0.83 DPP4 (0.56) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL13142342 0.82 DPP4 (0.37) DPP4DPP9ARG1TDP1
SCHEMBL13981419 0.81 DPP4 (0.40) DPP4MVDEYA2APPACE
SCHEMBL31688025 0.81 DPP4 (0.42) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL13045705 0.80 DPP4 (0.36) DPP4DPP9ARG1
SCHEMBL11459947 0.79 SLC7A5 (0.52) GABRPGABRDGABRA1GABRB1GABRG2
Hydrochloric Acid SCHEMBL3750493 0.79 DPP4 (0.41) GABRPGABRDGABRA1GABRB1GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114901317-A Bicyclic peptide ligand drug conjugates 拜斯科技术开发有限公司 2022-08-12 — — CN claimed
CN-117203219-A Bicyclic peptide ligands specific for P-selectin 拜斯科技术开发有限公司 2023-12-08 — — CN disclosed
CN-116615411-A Process for producing peptide compound containing N-substituted amino acid residue 中外制药株式会社 2023-08-18 — — CN disclosed
CN-114901317-A Bicyclic peptide ligand drug conjugates 拜斯科技术开发有限公司 2022-08-12 — — CN disclosed
EP-0071544-B1 PHOSPHONAMIDATE COMPOUNDS E.R. Squibb & Sons, Inc. (US) 1986-10-08 — — EP disclosed
US-4432972-A HYPOTENSIVE AGENTS, KANALGESICS, AND ANGIOTENSIN AND ENKEPHALIN INHIBITION E. R. SQUIBB & SONS, INC. (US) 1984-02-21 — — US disclosed
US-4432971-A HYPOTENSIVE AGENTS AND ANGIOTENSIN INHIBITION E. R. SQUIBB & SONS, INC. (US) 1984-02-21 — — US disclosed
EP-0071544-A1 Phosphonamidate compounds E.R. Squibb & Sons, Inc. (US) 1983-02-09 — — EP disclosed
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