SCHEMBL4029464

SCHEMBL4029464

Cc1cccc(-c2ncoc2-c2ccc3ncsc3c2)n1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 4/20 0.60
TGFBR1 P36897 16/20 0.55
BMPR1A P36894 1/20 0.45
SMAD2 Q15796 1/20 0.45
DYRK1A Q13627 1/20 0.42

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
SCHEMBL4030130 0.80 TGFBR1 (0.63) MAPK14TGFBR1
SCHEMBL12373227 0.80 MAPK14 (0.71) MAPK14TGFBR1BMPR1ASMAD2DYRK1A
SCHEMBL4031433 0.78 TGFBR1 (0.54) MAPK14TGFBR1
SCHEMBL4032155 0.77 TGFBR1 (0.44) MAPK14TGFBR1
SCHEMBL38654884 0.77 TGFBR1 (0.56) MAPK14TGFBR1BMPR1ASMAD2DYRK1A
SCHEMBL4038621 0.75 TGFBR1 (0.40) MAPK14TGFBR1
SCHEMBL6881791 0.75 TGFBR1 (0.67) MAPK14TGFBR1BMPR1ASMAD2
SCHEMBL12373289 0.75 MAPK14 (1.00) MAPK14TGFBR1DYRK1A
SCHEMBL4029863 0.74 MAPK14 (0.47) MAPK14TGFBR1
SCHEMBL4032592 0.73 TGFBR1 (0.55) MAPK14TGFBR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1542994-B1 NOVEL OXAZOLE COMPOUNDS AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITOR PFIZER PROD INC (US) 2009-04-29 EP claimed
EP-1542994-B1 NOVEL OXAZOLE COMPOUNDS AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITOR PFIZER PROD INC (US) 2009-04-29 EP disclosed
US-7273936-B2 Oxazole and thiazole compounds as transforming growth factor (TGF) inhibitors PFIZER INC. (US) 2007-09-25 US disclosed
EP-1542994-A1 NOVEL TRIAZOLE AND OXAZOLE COMPOUNDS AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITOR Pfizer Products Inc. (US) 2005-06-22 EP disclosed
US-20040110797-A1 Novel oxazole and thiazole compounds as transforming growth factor (TGF) inhibitors PFIZER INC 2004-06-10 US disclosed
WO-2004026863-A1 NOVEL OXAZOLE AND THIAZOLE COMPOUNDS AS TRANSFORMING GROWTH FACTOR (TGF) INHIBITORS PFIZER PRODUCTS INC. (US) 2004-04-01 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 (1 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-20040110797-A1 Novel oxazole and thiazole compounds as transforming growth factor (TGF) inhibitors TGFBR1, TGFBR2, SMAD3 MAPK14 319/4885TGFBR1 1/4885BMPR1A 88/4885

“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.