SCHEMBL3821550

SCHEMBL3821550

CCC(C)(C)C(N)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.52
MAPT P10636 1/20 0.52
PTGS1 P23219 1/20 0.52
DPP4 P27487 2/20 0.38
SLC1A2 P43004 4/20 0.37
SLC1A1 P43005 4/20 0.37
SLC1A3 P43003 3/20 0.37
SLC7A5 Q01650 2/20 0.36
GRIK1 P39086 4/20 0.35
GRIK2 Q13002 3/20 0.35
KDM4E B2RXH2 1/20 0.34
KIF11 P52732 1/20 0.33

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
SCHEMBL1631413 1.00 ALDH1A1 (0.52) ALDH1A1MAPTPTGS1DPP4SLC1A2
Hydrochloric Acid SCHEMBL23462497 0.98 ALDH1A1 (0.50) ALDH1A1MAPTPTGS1DPP4SLC1A2
Hydrochloric Acid SCHEMBL7379812 0.98 ALDH1A1 (0.50) ALDH1A1MAPTPTGS1DPP4SLC1A2
SCHEMBL20960490 0.82 PTGS1 (0.54) ALDH1A1MAPTPTGS1SLC1A2SLC1A1
SCHEMBL9358019 0.81 ALDH1A1 (0.48) ALDH1A1MAPTPTGS1SLC1A2SLC1A1
SCHEMBL20738916 0.80 DPP4 (0.38) ALDH1A1MAPTPTGS1DPP4
SCHEMBL4956090 0.80 PTGS1 (0.52) ALDH1A1MAPTPTGS1SLC1A2SLC1A1
SCHEMBL5288950 0.80 ALDH1A1 (0.52) ALDH1A1MAPTPTGS1DPP4SLC1A2
SCHEMBL4851556 0.80 PTGS1 (0.52) ALDH1A1MAPTPTGS1SLC1A2SLC1A1
SCHEMBL28705428 0.80 PTGS1 (0.52) ALDH1A1MAPTPTGS1SLC1A2SLC1A1

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 73 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117062826-A Antiinfective bicyclic peptide ligands 拜斯科技术开发有限公司 2023-11-14 CN claimed
CN-116802190-A Bicyclic peptide ligands specific for transferrin receptor 1 (TfR 1) 拜斯科技术开发有限公司 2023-09-22 CN claimed
EP-3335720-A1 C-DI-GMP BINDING PEPTIDES Universität Basel (CH) 2018-06-20 EP claimed
US-9376694-B2 Method for preparing optically active amino acid using cosubstrate shuttling of transaminase INDUSTRY-ACADEMIC COOPERATION FOUNDATION, YONSEI UNIVERSITY (KR) 2016-06-28 US claimed
US-20150284750-A1 METHOD FOR PREPARING OPTICALLY ACTIVE AMINO ACID USING COSUBSTRATE SHUTTLING OF TRANSAMINASE INDUSTRY-ACADEMIC COOPERATION FOUNDATION, YONSEI UNIVERSITY (KR) 2015-10-08 US claimed
CN-1578786-A Linear basic compounds having NK-2 antagonistic activity and formulations thereof MENARINI RICERCHE SPA (IT) 2005-02-09 CN claimed
US-20040259930-A1 Linear basic compounds having nk-2 antagonist activity and formulations thereof MALESCI INSTITUTO FARMACOBIOLOGICO S.P.A. (IT) 2004-12-23 US claimed
US-5658885-A OLIGOPEPTIDES; ANTICOAGULANTS; ENZYME INHIBITORS; THROMBIN THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) 1997-08-19 US claimed
EP-0626941-A1 PROCESS FOR THE PREPARATION OF $g(b),$g(b)-DIALKYL AND $g(b),$g(b),$g(b)-TRIALKYL $g(a)-AMINO ACIDS THE ASSOCIATED OCTEL COMPANY LIMITED (GB) 1994-12-07 EP claimed
WO-1993016032-A1 PROCESS FOR THE PREPARATION OF β,β-DIALKYL AND β,β,β-TRIALKYL α-AMINO ACIDS THE ASSOCIATED OCTEL COMPANY LIMITED (GB) 1993-08-19 WO claimed
US-12630521-B2 Arylamides and methods of use thereof GENZYME CORPORATION (US) 2026-05-19 US disclosed
US-12630498-B2 Arylamides and methods of use thereof GENZYME CORPORATION (US) 2026-05-19 US disclosed
US-12552839-B2 Cyclic peptides for protection against respiratory syncytial virus VIROMETIX AG (CH) 2026-02-17 US disclosed
EP-4684030-A2 METHOD OF DEPROTECTING AT LEAST ONE D-AMINO ACID AND/OR D-AMINO ACID DERIVATIVE PROTECTED FUNCTIONAL GROUP Martin-Luther-Universität Halle-Wittenberg (DE) 2026-01-28 EP disclosed
US-20250059171-A1 ANTIVIRAL COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2025-02-20 US disclosed
US-5516755-A Antitumor and antibacterial peptide and methods of use HARBOR BRANCH OCEANOGRAPHIC INSTITUTION, INC. (US) 1996-05-14 US disclosed
WO-1996012499-A1 AMIDINO AND GUANIDINO SUBSTITUTED INHIBITORS OF TRYPSIN-LIKE ENZYMES THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1996-05-02 WO disclosed
EP-0626941-A1 PROCESS FOR THE PREPARATION OF $g(b),$g(b)-DIALKYL AND $g(b),$g(b),$g(b)-TRIALKYL $g(a)-AMINO ACIDS THE ASSOCIATED OCTEL COMPANY LIMITED (GB) 1994-12-07 EP disclosed
US-5336757-A Antibacterial peptide and methods of use HARBOR BRANCH OCEANOGRAPHIC INSTITUTION, INC. (US) 1994-08-09 US disclosed
WO-1993016032-A1 PROCESS FOR THE PREPARATION OF β,β-DIALKYL AND β,β,β-TRIALKYL α-AMINO ACIDS THE ASSOCIATED OCTEL COMPANY LIMITED (GB) 1993-08-19 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12630521-B2 Arylamides and methods of use thereof CFTR, CLIC1, CLCN2 ALDH1A1 905/4885MAPT 4872/4885PTGS1 3305/4885
US-20040259930-A1 Linear basic compounds having nk-2 antagonist activity and formulations thereof BDKRB2, BDKRB1, TACR2 ALDH1A1 2231/4885MAPT 4098/4885PTGS1 413/4885
US-12630498-B2 Arylamides and methods of use thereof CFTR, CLIC1, CLCN2 ALDH1A1 775/4885MAPT 4884/4885PTGS1 3165/4885
US-12552839-B2 Cyclic peptides for protection against respiratory syncytial virus CTH, VIP, CXCL10 ALDH1A1 4815/4885MAPT 4663/4885PTGS1 3432/4885
US-20250059171-A1 ANTIVIRAL COMPOUNDS ZC3HAV1, ACE, EIF2AK2 ALDH1A1 2030/4885MAPT 2772/4885PTGS1 1592/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.