Y-39983

Y-39983

SCHEMBL226557

CC(N)c1ccc(C(=O)Nc2ccnc3[nH]ccc23)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ROCK1ROCK2

The experimentally established mechanism targets of Y-39983. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 known ✓ O75116 7/20 1.00
ROCK1 known ✓ Q13464 5/20 1.00
CIT O14578 9/20 1.00
PRKD3 O94806 2/20 1.00
PRKACA P17612 2/20 1.00
PRKCQ Q04759 2/20 1.00
PRKCD Q05655 2/20 1.00
PKN2 Q16513 2/20 1.00
PRKD2 Q9BZL6 2/20 1.00
MAP4K4 O95819 1/20 1.00
PRKCB P05771 1/20 1.00
PRKCA P17252 1/20 1.00
CSNK2A2 P19784 1/20 1.00
MARK3 P27448 1/20 1.00
BMPR1A P36894 1/20 1.00
CSNK1A1 P48729 1/20 1.00
CLK1 P49759 1/20 1.00
GSK3A P49840 1/20 1.00
GSK3B P49841 1/20 1.00
CDK9 P50750 1/20 1.00

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
Y-39983 SCHEMBL29431274 1.00 CIT (1.00) CITROCK2ROCK1PRKD3PRKACA
Y-39983 SCHEMBL226556 1.00 CIT (1.00) CITROCK2ROCK1PRKD3PRKACA
Y-39983 SCHEMBL25685649 1.00 CIT (1.00) CITROCK2ROCK1PRKD3PRKACA
Y-39983 SCHEMBL29893202 1.00 CIT (1.00) CITROCK2ROCK1PRKD3PRKACA
Y-39983 SCHEMBL29816387 0.99 ROCK2 (1.00) CITROCK2ROCK1PRKD3PRKACA
Y-39983 SCHEMBL599801 0.99 ROCK2 (1.00) CITROCK2ROCK1PRKD3PRKACA
Y-39983 SCHEMBL599800 0.99 ROCK2 (1.00) CITROCK2ROCK1PRKD3PRKACA
Y-39983 SCHEMBL29666940 0.99 ROCK2 (1.00) CITROCK2ROCK1PRKD3PRKACA
Y-39983 SCHEMBL1927760 0.99 ROCK2 (1.00) CITROCK2ROCK1PRKD3PRKACA
Y-39983 SCHEMBL1927761 0.99 ROCK2 (1.00) CITROCK2ROCK1PRKD3PRKACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240245668-A1 AGENT FOR TREATING OR PREVENTING GLAUCOMA INCLUDING A SULFONAMIDE COMPOUND AND ANOTHER DRUG SANTEN PHARMACEUTICAL CO., LTD. (JP) 2024-07-25 US claimed
US-20210330654-A1 AGENT FOR TREATING OR PREVENTING GLAUCOMA INCLUDING A SULFONAMIDE COMPOUND AND ANOTHER DRUG SANTEN PHARMACEUTICAL CO., LTD. (JP) 2021-10-28 US claimed
US-20200224159-A1 UNIFIED CELL DIFFERENTIATION PROTOCOL EYESTEM RESEARCH PRIVATE LIMITED (IN) 2020-07-16 US claimed
US-20200121652-A1 COMPOUNDS HAVING CASPASE INHIBITORY ACTIVITY, PHARMACEUTICAL AGENT CONTAINING SAID COMPOUNDS AND FOR TREATING OR PREVENTING CORNEAL ENDOTHELIAL SYMPTOMS, DISORDERS, OR DISEASES, AND APPLICATION OF SAID PHARMACEUTICAL AGENT THE DOSHISHA (JP) 2020-04-23 US claimed
EP-3639855-A1 COMPOUNDS HAVING CASPASE INHIBITORY ACTIVITY, PHARMACEUTICAL AGENT CONTAINING SAID COMPOUNDS AND FOR TREATING OR PREVENTING CORNEAL ENDOTHELIAL SYMPTOMS, DISORDERS, OR DISEASES, AND APPLICATION OF SAID PHARMACEUTICAL AGENT The Doshisha (JP) 2020-04-22 EP claimed
US-20200085804-A1 AGENT FOR TREATING OR PREVENTING GLAUCOMA INCLUDING A SULFONAMIDE COMPOUND AND ANOTHER DRUG SANTEN PHARMACEUTICAL CO., LTD. (JP) 2020-03-19 US claimed
EP-1378247-B1 VISUAL FUNCTION DISORDER IMPROVING AGENTS SENJU PHARMA CO (JP) 2016-08-24 EP claimed
US-20160228421-A1 COMPOSITION FOR TREATING OR PREVENTING GLAUCOMA COMPRISING A SULFONAMIDE COMPOUND AND ANOTHER DRUG SANTEN PHARMACEUTICAL CO., LTD. (JP) 2016-08-11 US claimed
EP-3043822-A1 COMPOSITIONS FOR PREPARING CARDIOMYOCYTES The J. David Gladstone Institutes, A Testamentary Trust Established under The Will of J. David Gladstone (US) 2016-07-20 EP claimed
US-20160186141-A1 SMALL MOLECULE CELLULAR REPROGRAMMING TO GENERATE CARDIOMYOCYTES The J. David Gladstone Institutes, a testamentary trust established under the Will of J. David Glad 2016-06-30 US claimed
CN-1362884-A Preventives/remedies for liver diseases MITSUBISHI PHARMACEUTICAL CO L (JP) 2002-08-07 CN claimed
CN-1358102-A Preventives/remedies for angiostenosis MITSUBISHI PHARMACEUTICAL CO L (JP) 2002-07-10 CN claimed
CN-1351504-A Prophylactic and therapeutic agent for interstitial pneumonia and pulmonary fibrosis YOSHITOMI PHARMACEUTICAL (JP) 2002-05-29 CN claimed
EP-1195372-A1 N-heterocyclic substituted benzamide derivatives with antihypertensive activity Mitsubishi Pharma Corporation (JP) 2002-04-10 EP claimed
EP-1177796-A1 PREVENTIVES/REMEDIES FOR LIVER DISEASES Mitsubishi Pharma Corporation (JP) 2002-02-06 EP claimed
EP-1174150-A1 PREVENTIVES/REMEDIES FOR ANGIOSTENOSIS Mitsubishi Pharma Corporation (JP) 2002-01-23 EP claimed
EP-1163910-A1 PREVENTIVES/REMEDIES FOR INTERSTITIAL PNEUMONIA AND PULMONARY FIBROSIS Welfide Corporation (JP) 2001-12-19 EP claimed
CN-1287494-A Preventive/remedy for glaucoma SENJI PHARMACEUTICAL CO LTD (JP) 2001-03-14 CN claimed
EP-1034793-A1 PREVENTIVES/REMEDIES FOR GLAUCOMA Senju Pharmaceutical Co., Ltd. (JP) 2000-09-13 EP claimed
EP-0757038-A1 BENZAMIDE COMPOUND AND MEDICINAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-02-05 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 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-20160228421-A1 COMPOSITION FOR TREATING OR PREVENTING GLAUCOMA COMPRISING A SULFONAMIDE COMPOUND AND ANOTHER DRUG PTGIS, PTGIR, PTGS1 ROCK2 517/4885ROCK1 652/4885CIT 3233/4885
US-20200085804-A1 AGENT FOR TREATING OR PREVENTING GLAUCOMA INCLUDING A SULFONAMIDE COMPOUND AND ANOTHER DRUG PTGIS, PTGIR, PTGS1 ROCK2 422/4885ROCK1 517/4885CIT 2802/4885
US-20160186141-A1 SMALL MOLECULE CELLULAR REPROGRAMMING TO GENERATE CARDIOMYOCYTES MYLK2, TNNI3, TNNT2 ROCK2 90/4885ROCK1 186/4885CIT 268/4885
US-20240245668-A1 AGENT FOR TREATING OR PREVENTING GLAUCOMA INCLUDING A SULFONAMIDE COMPOUND AND ANOTHER DRUG PTGIS, PTGIR, PTGS1 ROCK2 539/4885ROCK1 725/4885CIT 2410/4885
US-20200121652-A1 COMPOUNDS HAVING CASPASE INHIBITORY ACTIVITY, PHARMACEUTICAL AGENT CONTAINING SAID COMPOUNDS AND FOR TREATING OR PREVENTING CORNEAL ENDOTHELIAL SYMPTOMS, DISORDERS, OR DISEASES, AND APPLICATION OF SAID PHARMACEUTICAL AGENT TGFB1, CASP3, TGFB2 ROCK2 2015/4885ROCK1 1167/4885CIT 1381/4885
US-20210330654-A1 AGENT FOR TREATING OR PREVENTING GLAUCOMA INCLUDING A SULFONAMIDE COMPOUND AND ANOTHER DRUG PTGIS, PTGIR, PTGS1 ROCK2 539/4885ROCK1 725/4885CIT 2410/4885

“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.