SCHEMBL6433233

SCHEMBL6433233

CC(C)(C)OC(=O)CC(NC(=O)c1ccc2c(Cl)cnc(NC(=N)N)c2c1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 8/20 0.41
ROCK1 Q13464 7/20 0.41
DYRK1A Q13627 5/20 0.37
DYRK1B Q9Y463 5/20 0.37
PPARG P37231 3/20 0.36
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
TACR3 P29371 1/20 0.36

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
SCHEMBL7369537 0.88 CTSA (0.46) ROCK2ROCK1ITGB3ITGA2B
SCHEMBL6433264 0.87 ROCK2 (0.44) ROCK2ROCK1PPARGTACR3
SCHEMBL6436986 0.85 ROCK2 (0.34) ROCK2
Trifluoroacetic Acid SCHEMBL6434862 0.85 CTSA (0.42) ROCK2ROCK1ITGB3ITGA2B
SCHEMBL6437336 0.83 ROCK2 (0.48) ROCK2
SCHEMBL6437624 0.82 PTPRC (0.43)
SCHEMBL6433846 0.80 DGAT2 (0.47)
SCHEMBL6432919 0.79 CA1 (0.39)
SCHEMBL6432702 0.79 GRN (0.41) ROCK2
SCHEMBL6434410 0.79 MAPT (0.45)

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050026836-A1 Composition for the treatment of damaged tissue DACK KEVIN NEIL (GB) 2005-02-03 US disclosed
US-20030199440-A1 Composition for the treatment of damaged tissue PFIZER INC. 2003-10-23 US disclosed
EP-1077945-B1 ISOQUINOLINES AS UROKINASE INHIBITORS PFIZER (US) 2003-01-08 EP disclosed
EP-1242120-A2 COMBINATIONS OF GROWTH FACTORS AND I:UPA OR I:MMP FOR THE TREATMENT OF DAMAGED TISSUE Pfizer Limited (GB) 2002-09-25 EP disclosed
WO-2001049309-A2 COMBINATIONS OF GROWTH FACTORS AND I: UPA OR I: MMP FOR THE TREATMENT OF DAMAGED TISSUE PFIZER LIMITED (GB) 2001-07-12 WO disclosed
EP-1077945-A1 ISOQUINOLINES AS UROKINASE INHIBITORS PFIZER INC. (US) 2001-02-28 EP disclosed
US-6093731-A Isoquinolines PFIZER INC. 2000-07-25 US disclosed
WO-2000005214-A2 ISOQUINOLINES AS UROKINASE INHIBITORS PFIZER INC. (US) 2000-02-03 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 (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-20030199440-A1 Composition for the treatment of damaged tissue MMP1, SERPINE1, COL14A1 ROCK2 2546/4885ROCK1 1845/4885DYRK1A 4651/4885
US-20050026836-A1 Composition for the treatment of damaged tissue MMP1, SERPINE1, COL14A1 ROCK2 2546/4885ROCK1 1845/4885DYRK1A 4651/4885

“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.