SCHEMBL2449133

SCHEMBL2449133

O=C1CNC(=O)c2ccccc2N1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 2/20 0.55
▸ DYRK1B Q9Y463 2/20 0.55
▸ PDGFRA P16234 1/20 0.55
▸ FER P16591 1/20 0.55
▸ LTK P29376 1/20 0.55
▸ CDK8 P49336 1/20 0.55
▸ ACVR1 Q04771 1/20 0.55
▸ CA12 O43570 1/20 0.53
▸ CA9 Q16790 1/20 0.53
▸ MAOA P21397 1/20 0.50
▸ MAOB P27338 1/20 0.50
▸ GABRA1 P14867 1/20 0.45
▸ GABRG2 P18507 1/20 0.45
▸ GABRB3 P28472 1/20 0.45
▸ GABRA5 P31644 1/20 0.45
▸ GABRA3 P34903 1/20 0.45
▸ GABRA2 P47869 1/20 0.45
▸ GABRB2 P47870 1/20 0.45
▸ AHR P35869 1/20 0.44
▸ PDK2 Q15119 1/20 0.44

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
SCHEMBL30336371 1.00 LRRK2 (0.55) LRRK2DYRK1BPDGFRAFERLTK
Trifluoroacetic Acid SCHEMBL8836917 0.86 LRRK2 (0.42) LRRK2DYRK1BPDGFRAFERLTK
Ethyne SCHEMBL8836911 0.84 LRRK2 (0.41) LRRK2DYRK1BPDGFRAFERLTK
SCHEMBL9025284 0.84 PDGFRA (0.55) LRRK2DYRK1BPDGFRAFERLTK
SCHEMBL7404124 0.81 CA12 (0.55) LRRK2DYRK1BPDGFRAFERLTK
SCHEMBL8836954 0.79 LRRK2 (0.36) LRRK2DYRK1BPDGFRAFERLTK
SCHEMBL29483964 0.79 AHR (0.50) LRRK2DYRK1BPDGFRAFERLTK
SCHEMBL37900 0.79 AHR (0.50) LRRK2DYRK1BPDGFRAFERLTK
SCHEMBL6619938 0.78 CLK4 (0.62) LRRK2DYRK1BMAOAMAOBGSK3B
SCHEMBL21619357 0.76 CMA1 (0.51) LRRK2DYRK1BCA9AHRCDK5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1448531-A1 3-CYANOQUINOLINES AS INHIBITORS OF EGF-R AND HER2 KINASES Wyeth Holdings Corporation (US) 2004-08-25 — — EP claimed
EP-1117659-B1 SUBSTITUTED 3-CYANOQUINOLINES AS PROTEIN TYROSINE KINASES INHIBITORS WYETH CORP (US) 2003-12-03 — — EP claimed
US-20030149056-A1 3-cyanoquinolines as inhibitors of EGF-R and HER2 kinases AMERICAN CYANAMID COMPANY 2003-08-07 — — US claimed
WO-2003050090-A1 3-CYANOQUINOLINES AS INHIBITORS OF EGF-R AND HER2 KINASES WYETH HOLDINGS CORPORATION (US) 2003-06-19 — — WO claimed
US-6288082-B1 COMPOUNDS SUCH AS 6,7-DIETHOXY-4-(INDAN-5-YLAMINO) -QUINOLINE-3-CARBONITRILE USED AS ANTINEOPLASTIC AGENTS AND IN THE TREATMENT OF POLYCYCSTIC KIDNEY DISEASE AMERICAN CYANAMID COMPANY 2001-09-11 — — US claimed
EP-0610334-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII b?III a? RECEPTOR. GENENTECH INC (US) 1994-08-17 — — EP claimed
US-12577227-B2 WDR5 inhibitors and modulators VANDERBILT UNIVERSITY (US) 2026-03-17 — — US disclosed
US-20220242849-A1 WDR5 INHIBITORS AND MODULATORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-08-04 — — US disclosed
US-10975071-B2 Inhibitors of KRAS G12C mutant proteins ARAXES PHARMA LLC (US) 2021-04-13 — — US disclosed
WO-2021066578-A1 BICYCLIC COMPOUND AND USE THEREOF 에스케이바이오팜 주식회사 2021-04-08 — — WO disclosed
WO-2020247679-A1 WDR5 INHIBITORS AND MODULATORS VANDERBILT UNIVERSITY (US) 2020-12-10 — — WO disclosed
US-20200299306-A1 COMPOUNDS WITH A BENZO[A]CARBAZOLE STRUCTURE AND USE THEREOF UNIVERSITA' DI PISA (IT) 2020-09-24 — — US disclosed
EP-3679044-A1 COMPOUNDS WITH A BENZO[A]CARBAZOLE STRUCTURE AND USE THEREOF Università di Pisa (IT) 2020-07-15 — — EP disclosed
WO-1995021170-A1 ANTITUMOUR TETRACYCLIC COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1995-08-10 — — WO disclosed
US-5403836-A Anticoagulants GENENTECH, INC. (US) 1995-04-04 — — US disclosed
WO-1995004057-A1 TRICYCLIC INHIBITORS OF THE GPIIbIIIa RECEPTOR GENENTECH, INC. (US) 1995-02-09 — — WO disclosed
EP-0610334-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPII b?III a? RECEPTOR. GENENTECH INC (US) 1994-08-17 — — EP disclosed
US-5250679-A Nonpeptidyl platelet aggregation inhibitors having specificity for the GPIIb III.sub. receptor GENENTECH, INC. (US) 1993-10-05 — — US disclosed
WO-1993008174-A1 NONPEPTIDYL INTEGRIN INHIBITORS HAVING SPECIFICITY FOR THE GPIIbIIIa RECEPTOR GENENTECH, INC. (US) 1993-04-29 — — WO disclosed
EP-0150040-A2 Imidazodiazepine derivatives F. HOFFMANN-LA ROCHE AG (CH) 1985-07-31 — — 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 (5 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-20220242849-A1 WDR5 INHIBITORS AND MODULATORS WDR5, WDR1, WDR3 LRRK2 1406/4885DYRK1B 2149/4885PDGFRA 4440/4885
US-10975071-B2 Inhibitors of KRAS G12C mutant proteins KRAS, NRAS, HRAS LRRK2 39/4885DYRK1B 529/4885PDGFRA 2133/4885
US-12577227-B2 WDR5 inhibitors and modulators WDR1, WDR5, WDR3 LRRK2 1071/4885DYRK1B 2601/4885PDGFRA 3916/4885
US-20030149056-A1 3-cyanoquinolines as inhibitors of EGF-R and HER2 kinases EGFR, ERBB2, ERBB3 LRRK2 439/4885DYRK1B 350/4885PDGFRA 121/4885
US-20200299306-A1 COMPOUNDS WITH A BENZO[A]CARBAZOLE STRUCTURE AND USE THEREOF MKI67, CCNI, CASP3 LRRK2 1333/4885DYRK1B 3847/4885PDGFRA 534/4885

“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.

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