SCHEMBL43590

SCHEMBL43590

C[C@H](NC(C)(C)C)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 5/20 0.44
SLC6A2 P23975 5/20 0.40
CHRNA1 P02708 4/20 0.40
CHRNG P07510 4/20 0.40
CHRNB1 P11230 4/20 0.40
CHRNB2 P17787 4/20 0.40
CHRNB4 P30926 4/20 0.40
CHRNA3 P32297 4/20 0.40
CHRNA4 P43681 4/20 0.40
CHRND Q07001 4/20 0.40
SLC6A4 P31645 4/20 0.39
ITGA5 P08648 1/20 0.39
CYP2C19 P33261 1/20 0.39
HRH1 P35367 1/20 0.39
CHRNA7 P36544 1/20 0.39
OPRK1 P41145 1/20 0.39
KCNH2 Q12809 1/20 0.39
TP53 P04637 1/20 0.38
ALDH1A1 P00352 2/20 0.38
BLM P54132 1/20 0.38

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
SCHEMBL289160 1.00 SLC6A3 (0.44) SLC6A3SLC6A2CHRNA1CHRNGCHRNB1
SCHEMBL1716976 1.00 SLC6A3 (0.44) SLC6A3SLC6A2CHRNA1CHRNGCHRNB1
SCHEMBL43589 1.00 SLC6A3 (0.44) SLC6A3SLC6A2CHRNA1CHRNGCHRNB1
Hydrochloric Acid SCHEMBL29399049 0.97 SLC6A3 (0.42) SLC6A3SLC6A2CHRNA1CHRNGCHRNB1
Hydrochloric Acid SCHEMBL8190787 0.97 SLC6A3 (0.42) SLC6A3SLC6A2CHRNA1CHRNGCHRNB1
Hydrochloric Acid SCHEMBL8190786 0.97 SLC6A3 (0.42) SLC6A3SLC6A2CHRNA1CHRNGCHRNB1
SCHEMBL2946675 0.85 SLC6A3 (0.36) SLC6A3SLC6A2CHRNA1CHRNGCHRNB1
SCHEMBL2946672 0.85 SLC6A3 (0.36) SLC6A3SLC6A2CHRNA1CHRNGCHRNB1
SCHEMBL24766215 0.84 MME (0.48) SLC6A3SLC6A2CHRNA1CHRNGCHRNB1
SCHEMBL20677212 0.84 MME (0.48) SLC6A3SLC6A2CHRNA1CHRNGCHRNB1

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

Appears in 14251 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122094701-A TLR3 binding bicyclic peptide ligands 2026-05-26 CN claimed
US-12630588-B2 Bicyclic peptide ligands specific for CD137 BICYCLETX LIMITED (GB) 2026-05-19 US claimed
EP-4727653-A1 DLL3 TARGETING PEPTIDES AND CONSTRUCTS THEREOF Mariana Oncology Inc. (US) 2026-04-22 EP claimed
EP-4727654-A1 DLL3 TARGETING PEPTIDES AND CONSTRUCTS THEREOF Mariana Oncology Inc. (US) 2026-04-22 EP claimed
EP-4727655-A1 DLL3 TARGETING PEPTIDES AND CONSTRUCTS THEREOF Mariana Oncology Inc. (US) 2026-04-22 EP claimed
US-12606594-B2 Heterotandem bicyclic peptide complexes BICYCLETX LIMITED (GB) 2026-04-21 US claimed
US-20250340595-A1 BICYCLIC PEPTIDE LIGANDS SPECIFIC FOR TRANSFERRIN RECEPTOR 1 (TfR1) BICYCLETX LTD (GB) 2025-11-06 US claimed
US-20250325672-A1 ANTI-INFECTIVE BICYCLIC PEPTIDE LIGANDS BICYCLE TX LTD (GB) 2025-10-23 US claimed
US-12435107-B2 Heterotandem bicyclic peptide complex BICYCLETX LIMITED (GB) 2025-10-07 US claimed
US-12428447-B2 Peptide-based non-proteinaceous cargo delivery FELDAN BIO INC. (CA) 2025-09-30 US claimed
US-5952464-A OLIGOPEPTIDE WITH SELECTIVE NEUROTENSIN RECEPTOR AFFINITY LABELLED WITH METAL ISOTOPE OR RADIOACTIVE HALOGEN ISOTOPE; FOR DIAGNOSTIC IMAGING AND ANTICARCINOGENIC AGENTS MALLINCKRODT INC. (US) 1999-09-14 US claimed
US-5734018-A BIOSYNTHESIS DETECTION, ANALYZING METHOD TO OBTAIN PEPTIDE SEQUENCES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 1998-03-31 US claimed
EP-0752873-A1 LABELLED PEPTIDE COMPOUNDS MALLINCKRODT MEDICAL, INC. (US) 1997-01-15 EP claimed
EP-0725797-A1 BIVALENT THROMBIN INHIBITORS NATIONAL RESEARCH COUNCIL OF CANADA (CA) 1996-08-14 EP claimed
WO-1995022341-A1 LABELLED PEPTIDE COMPOUNDS MALLINCKRODT MEDICAL, INC. (US) 1995-08-24 WO claimed
WO-1995011921-A1 BIVALENT THROMBIN INHIBITORS NATIONAL RESEARCH COUNCIL OF CANADA (CA) 1995-05-04 WO claimed
US-4961873-A Absorbent composition containing a severely-hindered amine mixture with amine salts and/or aminoacid additives for the absorption of H2 S EXXON RESEARCH AND ENGINEERING COMPANY (US) 1990-10-09 US claimed
US-4895670-A SELECTIVITY EXXON RESEARCH AND ENGINEERING COMPANY (US) 1990-01-23 US claimed
US-4892674-A Addition of severely-hindered amine salts and/or aminoacids to non-hindered amine solutions for the absorption of H2 S EXXON RESEARCH AND ENGINEERING COMPANY (US) 1990-01-09 US claimed
EP-0242245-A2 Chemiluminescence method for assaying compounds containing primary amino groups using 1-cyano-2-substituted benz(f)- or naphth(f)isoindole fluorescers OREAD LABORATORIES, INC. (US) 1987-10-21 EP claimed