SCHEMBL3411245

SCHEMBL3411245

Cn1cnc2ccc(C=O)cc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 3/20 0.50
DYRK1A Q13627 6/20 0.47
FGFR1 P11362 1/20 0.45
CLK1 P49759 5/20 0.44
CLK4 Q9HAZ1 5/20 0.44
DYRK1B Q9Y463 5/20 0.44
DYRK3 O43781 3/20 0.44
CLK2 P49760 3/20 0.44
CLK3 P49761 3/20 0.44
DYRK2 Q92630 3/20 0.44
DYRK4 Q9NR20 3/20 0.44
CDK5 Q00535 2/20 0.44
CDK5R1 Q15078 2/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
GSK3B P49841 1/20 0.44
IP6K1 Q92551 1/20 0.43
PRKCI P41743 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL13136914 0.88 DYRK1A (0.59) CYP2A6DYRK1AFGFR1CLK1CLK4
SCHEMBL541566 0.86 HDAC1 (0.58) CYP2A6FGFR1HDAC1HDAC8ALDH1A1
SCHEMBL13137075 0.83 DYRK1A (0.54) DYRK1AFGFR1IP6K1PRKCI
SCHEMBL5695722 0.82 DYRK1A (0.47) DYRK1ACLK1CLK4DYRK1BDYRK3
SCHEMBL13931440 0.79 HDAC1 (0.50) CYP2A6FGFR1HDAC1HDAC8ALDH1A1
SCHEMBL13136913 0.78 HDAC1 (0.51) CYP2A6DYRK1AHDAC1HDAC8ALDH1A1
SCHEMBL5695756 0.78 HDAC1 (0.48) CYP2A6FGFR1HDAC1HDAC8ALDH1A1
SCHEMBL29408444 0.78 HDAC1 (0.42) CYP2A6DYRK1AFGFR1HDAC1HDAC8
SCHEMBL13136930 0.77 HDAC1 (0.41) CYP2A6DYRK1AHDAC1HDAC8IP6K1
SCHEMBL25941136 0.76 DYRK1A (0.45) DYRK1ACLK1CLK4DYRK1BDYRK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250340539-A1 IMIDAZOLONE DERIVATIVES AS INHIBITORS OF PROTEIN KINASES IN PARTICULAR DYRK1A, CLK1, AND/OR CLK4 PERHA PHARMACEUTICALS (FR) 2025-11-06 US disclosed
WO-2025128848-A1 HETEROCYCLIC COMPOUNDS AS TRIGGERING RECEPTOR EXPRESSED ON MYELOID CELLS 2 AGONISTS AND METHODS OF USE VIGIL NEUROSCIENCE, INC. (US) 2025-06-19 WO disclosed
EP-4422753-A1 IMIDAZOLONE DERIVATIVES AS INHIBITORS OF PROTEIN KINASES IN PARTICULAR DYRK1A, CLK1 AND/OR CLK4 Perha Pharmaceuticals (FR) 2024-09-04 EP disclosed
CN-114929690-B Novel heterocyclic derivatives having cardiomyocyte proliferative activity for the treatment of heart disease 同济大学 2023-05-05 CN disclosed
WO-2023072966-A1 IMIDAZOLONE DERIVATIVES AS INHIBITORS OF PROTEIN KINASES IN PARTICULAR DYRK1A, CLK1 AND/OR CLK4 PERHA PHARMACEUTICALS (FR) 2023-05-04 WO disclosed
EP-4173675-A1 IMIDAZOLONE DERIVATIVES AS INHIBITORS OF PROTEIN KINASES IN PARTICULAR DYRK1A, CLK1 AND/OR CLK4 Perha Pharmaceuticals (FR) 2023-05-03 EP disclosed
US-20230025301-A1 Novel Heterocyclic Derivatives with Cardiomyocyte Proliferation Activity for Treatment of Heart Diseases TONGJI UNIVERSITY (CN) 2023-01-26 US disclosed
US-20230025301-A1 Novel Heterocyclic Derivatives with Cardiomyocyte Proliferation Activity for Treatment of Heart Diseases TONGJI UNIVERSITY (CN) 2023-01-26 US disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-20220324878-A1 IMIDAZOLIDIN-2-ONE COMPOUNDS AS PRMT5 MODULATORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2022-10-13 US disclosed
US-20060247233-A1 Thiazoles inhibitors of the alk-5 receptor SMITHKLINE BEECHAM CORPORATION 2006-11-02 US disclosed
EP-1660494-A2 THIAZOLES AS INHIBITORS OF THE ALK-5 RECEPTOR SMITHKLINE BEECHAM CORPORATION (US) 2006-05-31 EP disclosed
EP-1656367-A1 4- (HETEROCYCLYL- FUSED PHENYL)- 3- (PHENYL OR PYRID -2- YL) PYRAZOLES AS INHIBITORS OF THE ALK-5- RECEPTOR SmithKline Beecham Corporation (US) 2006-05-17 EP disclosed
WO-2005082901-A1 NOVEL CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2005-09-09 WO disclosed
WO-2004111036-A1 4- (HETEROCYCLYL- FUSED PHENYL)- 3- (PHENYL OR PYRID -2- YL) PYRAZOLES AS INHIBITORS OF THE ALK-5- RECEPTOR SMITHKLINE BEECHAM CORPORATION (US) 2004-12-23 WO disclosed
WO-2004111046-A2 THIAZOLES AS INHIBITORS OF THE ALK- 5 RECEPTOR SMITHKLINE BEECHAM CORPORATION (US) 2004-12-23 WO disclosed
EP-1140944-B1 EPOTHILONE DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS NOVARTIS AG (CH) 2003-08-27 EP disclosed
US-6387927-B1 WATER SOLUBILITY NOVATIS AG (CH) 2002-05-14 US disclosed
EP-1140944-A1 EPOTHILONE DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS Novartis AG (CH) 2001-10-10 EP disclosed
WO-2000037473-A1 EPOTHILONE DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS NOVARTIS AG (CH) 2000-06-29 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 (4 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-20230025301-A1 Novel Heterocyclic Derivatives with Cardiomyocyte Proliferation Activity for Treatment of Heart Diseases TNNI3, TNNT2, MKI67 CYP2A6 1169/4885DYRK1A 3319/4885FGFR1 83/4885
US-20060247233-A1 Thiazoles inhibitors of the alk-5 receptor SMAD3, ALK, SMAD2 CYP2A6 4378/4885DYRK1A 459/4885FGFR1 24/4885
US-20220324878-A1 IMIDAZOLIDIN-2-ONE COMPOUNDS AS PRMT5 MODULATORS PRMT5, PRMT1, PRMT7 CYP2A6 3810/4885DYRK1A 2690/4885FGFR1 4213/4885
US-20250340539-A1 IMIDAZOLONE DERIVATIVES AS INHIBITORS OF PROTEIN KINASES IN PARTICULAR DYRK1A, CLK1, AND/OR CLK4 CLK1, CLK2, CLK3 CYP2A6 4388/4885DYRK1A 20/4885FGFR1 1358/4885

“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.