SCHEMBL4035486

SCHEMBL4035486

Cc1cccc(-c2nc(C)sc2-c2ccc3nccnc3c2)n1

nearest known ligand 0.78

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 20/20 0.78
MAPK14 Q16539 4/20 0.78
MTOR P42345 1/20 0.55
RIPK2 O43353 1/20 0.45
KDR P35968 1/20 0.45
ACVR1B P36896 1/20 0.45
PRKD1 Q15139 1/20 0.43

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
SCHEMBL4032888 0.90 TGFBR1 (0.63) TGFBR1MAPK14MTORRIPK2KDR
SCHEMBL4035145 0.88 TGFBR1 (1.00) TGFBR1MAPK14MTORRIPK2KDR
SCHEMBL4033696 0.88 TGFBR1 (0.61) TGFBR1MAPK14MTORKDRPRKD1
SCHEMBL5655965 0.82 TGFBR1 (0.55) TGFBR1MAPK14MTOR
SCHEMBL4030553 0.82 TGFBR1 (0.67) TGFBR1MAPK14MTORRIPK2KDR
SCHEMBL4032513 0.80 TGFBR1 (0.78) TGFBR1MAPK14MTOR
SCHEMBL4030048 0.80 TGFBR1 (0.78) TGFBR1MAPK14MTOR
SCHEMBL4033864 0.78 TGFBR1 (0.82) TGFBR1MAPK14MTORRIPK2KDR
SCHEMBL4031482 0.78 TGFBR1 (0.53) TGFBR1MAPK14MTORKDRPRKD1
SCHEMBL4035152 0.77 TGFBR1 (0.49) TGFBR1MAPK14MTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7273936-B2 Oxazole and thiazole compounds as transforming growth factor (TGF) inhibitors PFIZER INC. (US) 2007-09-25 US 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
CN-1681810-A Novel oxazole and thiazole compounds as transforming growth factor (TGF) inhibitors PFIZER PROD INC (US) 2005-10-12 CN disclosed
US-20040110797-A1 Novel oxazole and thiazole compounds as transforming growth factor (TGF) inhibitors PFIZER INC 2004-06-10 US 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 TGFBR1 1/4885MAPK14 319/4885MTOR 73/4885

“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.