SCHEMBL4097440

SCHEMBL4097440

O=C(O)CN1CCN(CC(=O)O)C[C@H](Cc2ccc(N=C=S)cc2)N(CC(=O)O)Cc2cccc(n2)C1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 1/20 0.39
GRIN2A Q12879 1/20 0.39
GRIN2B Q13224 1/20 0.39
TP53 P04637 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
ALOX12 P18054 1/20 0.35
OPRD1 P41143 1/20 0.34
FOLH1 Q04609 1/20 0.34
HSD17B10 Q99714 1/20 0.32
CHIT1 Q13231 2/20 0.31
DPP4 P27487 1/20 0.31
CHRM1 P11229 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
SCHEMBL9906197 1.00 GRIN1 (0.39) GRIN1GRIN2AGRIN2BTP53CYP1A2
SCHEMBL24828881 0.96 GRIN1 (0.37) GRIN1GRIN2AGRIN2BTP53CYP1A2
SCHEMBL9906211 0.94 GRIN1 (0.39) GRIN1GRIN2AGRIN2BTP53CYP1A2
SCHEMBL19479169 0.92 GRIN1 (0.37) GRIN1GRIN2AGRIN2BTP53CYP1A2
SCHEMBL23476607 0.90 FOLH1 (0.35) FOLH1CHIT1DPP4
SCHEMBL13558099 0.88 GRIN1 (0.35) GRIN1GRIN2AGRIN2BTP53CYP1A2
SCHEMBL15982269 0.87 GRIN1 (0.35) GRIN1GRIN2AGRIN2BTP53CYP1A2
SCHEMBL13558148 0.86 GRIN1 (0.39) GRIN1GRIN2AGRIN2BTP53CYP1A2
SCHEMBL19448807 0.86 GRIN1 (0.40) GRIN1GRIN2AGRIN2BTP53CYP1A2
SCHEMBL16644695 0.84 CHIT1 (0.37) FOLH1CHIT1DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4724457-A2 RADIOPHARMACEUTICAL COMPOSITIONS TARGETING GLYPICAN-3 AND USES THEREOF Rayzebio, Inc. (US) 2026-04-15 EP claimed
US-20260077071-A1 Targeted Delivery of Theranostic Agents PETER MACCALLUM CANCER INST (AU) 2026-03-19 US claimed
WO-2024254339-A9 RADIOPHARMACEUTICAL COMPOSITIONS TARGETING GLYPICAN-3 AND USES THEREOF RAYZEBIO, INC. (US) 2025-10-16 WO claimed
EP-4594337-A2 RADIOPHARMACEUTICAL COMPOSITIONS TARGETING EPHRIN TYPE-A RECEPTOR 2 AND USES THEREOF Rayzebio, Inc. (US) 2025-08-06 EP claimed
WO-2025137441-A1 RADIOPHARMACEUTICALS TARGETING SOMATOSTATIN RECEPTOR 2 AND USES THEREOF RAYZEBIO, INC. (US) 2025-06-26 WO claimed
WO-2025137443-A1 RADIOPHARMACEUTICAL COMPOSITIONS TARGETING SOMATOSTATIN RECEPTORS AND USES THEREOF RAYZEBIO, INC. (US) 2025-06-26 WO claimed
EP-4493578-A1 TARGETED DELIVERY OF THERANOSTIC AGENTS Peter MacCallum Cancer Institute (AU) 2025-01-22 EP claimed
WO-2024254339-A2 RADIOPHARMACEUTICAL COMPOSITIONS TARGETING GLYPICAN-3 AND USES THEREOF RAYZEBIO, INC. (US) 2024-12-12 WO claimed
US-20240342322-A1 Netrin-1 detection, companion test and therapy based on radiations CENTRE LEON BERARD (FR) 2024-10-17 US claimed
CN-118593732-A Myocarditis nuclide molecular probe and preparation method and application thereof 华中科技大学同济医学院附属同济医院 2024-09-06 CN claimed
EP-4377341-A1 NETRIN-1 DETECTION, COMPANION TEST AND THERAPY BASED ON RADIATIONS Netris Pharma (FR) 2024-06-05 EP claimed
WO-2024073622-A2 RADIOPHARMACEUTICAL COMPOSITIONS TARGETING EPHRIN TYPE-A RECEPTOR 2 AND USES THEREOF RAYZEBIO, INC. (US) 2024-04-04 WO claimed
CN-117813326-A Method for detection, concomitant testing and treatment of radiation-based guide-1 奈特里斯药物公司 2024-04-02 CN claimed
WO-2023173174-A1 TARGETED DELIVERY OF THERANOSTIC AGENTS PETER MACCALLUM CANCER INSTITUTE (AU) 2023-09-21 WO claimed
WO-2023006748-A1 NETRIN-1 DETECTION, COMPANION TEST AND THERAPY BASED ON RADIATIONS NETRIS PHARMA (FR) 2023-02-02 WO claimed
CN-114081969-A Labeled small molecule antibody, and labeling method and application thereof 成都纽瑞特医疗科技股份有限公司 2022-02-25 CN claimed
WO-2026101949-A1 COMPOUNDS TARGETING CARBONIC ANHYDRASE IX AND USES THEREOF RAYZEBIO, INC. (US) 2026-05-15 WO disclosed
US-20260124327-A1 Compounds Targeting Carbonic Anhydrase IX and Uses Thereof RAYZEBIO, INC. (US) 2026-05-07 US disclosed
US-20090202521-A1 Bifunctional Polyazamacrocyclic Chelating Agents MDS (CANADA) INC. (CA) 2009-08-13 US disclosed
WO-2007104135-A1 BIFUNCTIONAL POLYAZAMACROCYCLIC CHELATING AGENTS MDS (CANADA) INC. (CA) 2007-09-20 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 (3 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-20260077071-A1 Targeted Delivery of Theranostic Agents CCKAR, NPY1R, NPY2R GRIN1 1990/4885GRIN2A 2755/4885GRIN2B 2278/4885
US-20090202521-A1 Bifunctional Polyazamacrocyclic Chelating Agents LPXN, FCGRT, POLQ GRIN1 1051/4885GRIN2A 1680/4885GRIN2B 1860/4885
US-20260124327-A1 Compounds Targeting Carbonic Anhydrase IX and Uses Thereof CA9, CA13, CA4 GRIN1 3833/4885GRIN2A 4240/4885GRIN2B 3623/4885

“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.