SCHEMBL352831

SCHEMBL352831

CC(C)(C)OC(=O)NC1CCC(CN)CC1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.49
BTK Q06187 1/20 0.49
EPHX1 P07099 1/20 0.47
KDM1A O60341 1/20 0.46
MAOB P27338 1/20 0.46
CTSK P43235 2/20 0.46
DRD3 P35462 2/20 0.45
GAA P10253 2/20 0.44
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL3943582 1.00 DRD2 (0.49) DRD2BTKEPHX1KDM1AMAOB
SCHEMBL352832 1.00 DRD2 (0.49) DRD2BTKEPHX1KDM1AMAOB
Hydrochloric Acid SCHEMBL3513679 0.98 DRD2 (0.48) DRD2BTKEPHX1KDM1AMAOB
Hydrochloric Acid SCHEMBL30722908 0.98 DRD2 (0.48) DRD2BTKEPHX1KDM1AMAOB
Hydrochloric Acid SCHEMBL3513680 0.98 DRD2 (0.48) DRD2BTKEPHX1KDM1AMAOB
SCHEMBL3900940 0.90 BTK (0.54) DRD2BTKEPHX1KDM1AMAOB
SCHEMBL5549963 0.90 BTK (0.54) DRD2BTKEPHX1KDM1AMAOB
SCHEMBL3899249 0.90 BTK (0.54) DRD2BTKEPHX1KDM1AMAOB
SCHEMBL5524221 0.90 BTK (0.54) DRD2BTKEPHX1KDM1AMAOB
SCHEMBL23185506 0.89 DRD2 (0.50) DRD2BTKEPHX1KDM1AMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12454525-B2 IL4I1 inhibitors and methods of use MERCK SHARP & DOHME LLC (US) 2025-10-28 US disclosed
EP-4634169-A1 3-FLUORO-4-HYDROXYBENZMIDE-CONTAINING INHIBITORS AND/OR DEGRADERS AND USES THEREOF Pfizer Inc. (US) 2025-10-22 EP disclosed
WO-2025106771-A1 SMALL MOLECULES TO INCREASE NAD LEVELS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2025-05-22 WO disclosed
US-20250163043-A1 CDK9 INHIBITOR AND USE THEREOF TRANSTHERA SCIENCES (NANJING), INC. (CN) 2025-05-22 US disclosed
US-20250127800-A1 PYRIMIDINE OR PYRIDINE DERIVATIVE AND MEDICINAL USE THEREOF SIGNET THERAPEUTICS INC. (CN) 2025-04-24 US disclosed
WO-2025045758-A1 ANTIBODY-DRUG CONJUGATES BASED ON MOLECULAR GLUE DEGRADERS AND USES THEREOF MABLINK BIOSCIENCE (FR) 2025-03-06 WO disclosed
WO-2025045761-A1 MOLECULAR GLUE DEGRADERS AND USES THEREOF MABLINK BIOSCIENCE (FR) 2025-03-06 WO disclosed
EP-4512806-A1 MOLECULAR GLUE DEGRADERS AND USES THEREOF Mablink Bioscience (FR) 2025-02-26 EP disclosed
EP-4512427-A1 ANTIBODY-DRUG CONJUGATES BASED ON MOLECULAR GLUE DEGRADERS AND USES THEREOF Mablink Bioscience (FR) 2025-02-26 EP disclosed
EP-4472974-A2 HETEROCYCLIC COMPOUNDS AND METHODS OF USE Schrödinger, Inc. (US) 2024-12-11 EP disclosed
WO-2000018764-A1 BENZIMIDAZOLINYL PIPERIDINES AS CGRP LIGANDS MERCK SHARP & DOHME LIMITED (GB) 2000-04-06 WO disclosed
WO-1999022735-A1 SOMATOSTATIN AGONISTS MERCK & CO., INC. (US) 1999-05-14 WO disclosed
EP-0835109-A4 PYRIDINONE-THROMBIN INHIBITORS MERCK & CO INC (US) 1999-02-03 EP disclosed
WO-1998044921-A1 SOMATOSTATIN AGONISTS MERCK & CO., INC. (US) 1998-10-15 WO disclosed
US-5744486-A Pyridinone thrombin inhibitors MERCK & CO., INC. (US) 1998-04-28 US disclosed
EP-0835109-A1 PYRIDINONE-THROMBIN INHIBITORS Merck & Co., Inc. (US) 1998-04-15 EP disclosed
US-5714485-A Piperidine and hexahydropyridazine thrombin inhibitors MERCK & CO., INC. (US) 1998-02-03 US disclosed
US-5668289-A Pyridinone thrombin inhibitors MERCK & CO., INC. (US) 1997-09-16 US disclosed
WO-1997001338-A1 PYRIDINONE-THROMBIN INHIBITORS MERCK & CO., INC. (US) 1997-01-16 WO disclosed
US-5510369-A ANTICOAGULANTS MERCK & CO., INC. (US) 1996-04-23 US 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-20250163043-A1 CDK9 INHIBITOR AND USE THEREOF CDK9, CDK19, CDKL1 DRD2 3418/4885BTK 759/4885EPHX1 1983/4885
US-12454525-B2 IL4I1 inhibitors and methods of use IL4I1, IL4, IL2 DRD2 4869/4885BTK 2059/4885EPHX1 1319/4885
US-20250127800-A1 PYRIMIDINE OR PYRIDINE DERIVATIVE AND MEDICINAL USE THEREOF PTK2, PDGFRB, PTK2B DRD2 3537/4885BTK 186/4885EPHX1 980/4885

“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.