SCHEMBL1851945

SCHEMBL1851945

CC(C)(C)COC(=O)CN

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.34
HSD17B10 Q99714 1/20 0.34
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 1/20 0.33
KDM4E B2RXH2 2/20 0.32
CYP1A2 P05177 1/20 0.32
MIF P14174 1/20 0.32
GLRA1 P23415 1/20 0.30
SLC6A9 P48067 1/20 0.30
OR51E2 Q9H255 1/20 0.30

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 SCHEMBL7314143 0.98 KDM4E (0.35) LMNAHSD17B10CYP2C19KMT2AKDM4E
SCHEMBL28285942 0.83 ALDH1A1 (0.37) LMNAKDM4ECYP1A2
SCHEMBL23049725 0.83 LMNA (0.33) LMNAHSD17B10KDM4ECYP1A2
SCHEMBL9325262 0.79 SERPINE1 (0.32) LMNAHSD17B10KDM4E
SCHEMBL23049572 0.79 LMNA (0.33) LMNAHSD17B10KDM4E
SCHEMBL722025 0.79 GAA (0.50) LMNAHSD17B10CYP2C19KMT2AMIF
SCHEMBL2485813 0.79 ADRA2A (0.42) LMNAHSD17B10CYP2C19KMT2ACYP1A2
SCHEMBL7588073 0.79 MAPK1 (0.37) LMNAKDM4ECYP1A2GLRA1SLC6A9
SCHEMBL2059154 0.78 MGAM (0.50) CYP2C19KMT2AKDM4EMIF
SCHEMBL20925319 0.78 CYP1A2 (0.61) LMNAHSD17B10KMT2ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113677692-A Neurotensin agonists and methods of preventing or treating pain using the same 健康与人类科学公司 2021-11-19 CN claimed
CN-113603387-A Waterproof concrete synergist and preparation method thereof 浙江鑫美博新材料有限公司 2021-11-05 CN claimed
EP-1586636-A1 Hydantoinase variants with improved properties and their use for the production of amino acids Degussa AG (DE) 2005-10-19 EP claimed
EP-1165763-B1 HYDANTOINASE VARIANTS WITH IMPROVED PROPERTIES AND THEIR USE FOR THE PRODUCTION OF AMINO ACIDS CALIFORNIA INST OF TECHN (US) 2005-06-22 EP claimed
WO-2005017171-A2 PROCESS FOR THE PRODUCTION OF D-AMINO ACIDS DEGUSSA AG (DE) 2005-02-24 WO claimed
JP-2003521235-A 2003-07-15 JP claimed
EP-1165763-A4 HYDANTOINASE VARIANTS WITH IMPROVED PROPERTIES AND THEIR USE FOR THE PRODUCTION OF AMINO ACIDS CALIFORNIA INST OF TECHN (US) 2003-05-28 EP claimed
EP-1165763-A1 HYDANTOINASE VARIANTS WITH IMPROVED PROPERTIES AND THEIR USE FOR THE PRODUCTION OF AMINO ACIDS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2002-01-02 EP claimed
WO-2000058449-A1 HYDANTOINASE VARIANTS WITH IMPROVED PROPERTIES AND THEIR USE FOR THE PRODUCTION OF AMINO ACIDS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2000-10-05 WO claimed
EP-0299397-A2 Peptides with vasorelaxing, natriuretic and diuretic activities, preparation process, agents containing them and their use HOECHST AKTIENGESELLSCHAFT (DE) 1989-01-18 EP claimed
US-12459974-B2 Bicyclic peptide ligands specific for Nectin-4 BICYCLETX LIMITED (GB) 2025-11-04 US disclosed
EP-4610269-A1 UROKINASE PLASMINOGEN ACTIVATOR SURFACE RECEPTOR (UPAR) LIGANDS FOR DIAGNOSTIC OR THERAPEUTIC USE 3B Pharmaceuticals GmbH (DE) 2025-09-03 EP disclosed
US-20250263438-A9 BICYCLIC PEPTIDE LIGANDS SPECIFIC FOR NECTIN-4 BICYCLETX LIMITED (GB) 2025-08-21 US disclosed
EP-4588934-A2 BICYCLIC PEPTIDE LIGANDS SPECIFIC FOR NECTIN-4 BicycleTX Limited (GB) 2025-07-23 EP disclosed
CN-120152745-A Compounds and their use for detecting diseases in exhaled breath of a subject 奥斯通医疗有限公司 2025-06-13 CN disclosed
CN-1200374-A Vitronectin receptor antagonists, their preparation and use HOECHST AG (DE) 1998-12-02 CN disclosed
WO-1998040092-A1 DOLASTATIN-15 DERIVATIVES IN COMBINATION WITH TAXANES BASF AKTIENGESELLSCHAFT (DE) 1998-09-17 WO disclosed
CN-1193022-A Heterocyclic compound used as leucocyte adherence inhibitor and VLA-4 antagonist HOECHST AG (DE) 1998-09-16 CN disclosed
CN-1187490-A 5-membered ring heterocycles as inhibitors of leucocyte adhesion and as VLA-4 antagonists HOECHST AG (DE) 1998-07-15 CN disclosed
EP-0299397-A2 Peptides with vasorelaxing, natriuretic and diuretic activities, preparation process, agents containing them and their use HOECHST AKTIENGESELLSCHAFT (DE) 1989-01-18 EP 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 (2 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-12459974-B2 Bicyclic peptide ligands specific for Nectin-4 NECTIN4, VCAM1, SIGLEC7 LMNA 2666/4885HSD17B10 3873/4885CYP2C19 4698/4885
US-20250263438-A9 BICYCLIC PEPTIDE LIGANDS SPECIFIC FOR NECTIN-4 NECTIN4, VCAM1, SIGLEC7 LMNA 2666/4885HSD17B10 3873/4885CYP2C19 4698/4885

“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.