SCHEMBL4867341

SCHEMBL4867341

Cc1cccc(-c2nn3ccccc3c2-c2ccc(F)c(C=O)c2)n1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 16/20 0.47
THRB P10828 6/20 0.47
MAPK14 Q16539 3/20 0.40
EGFR P00533 1/20 0.40
RAF1 P04049 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
ADORA2A P29274 1/20 0.40
ADORA2B P29275 1/20 0.40
ADORA1 P30542 1/20 0.40
GSK3B P49841 1/20 0.40
TGFBR2 P37173 4/20 0.39
MAP3K20 Q9NYL2 3/20 0.39
CYP2D6 P10635 1/20 0.37
CHRM1 P11229 1/20 0.34

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
SCHEMBL4873746 0.84 TGFBR1 (0.47) TGFBR1THRBMAPK14EGFRRAF1
SCHEMBL4865390 0.83 TGFBR1 (0.46) TGFBR1THRBMAPK14EGFRRAF1
SCHEMBL4872814 0.82 MAPK14 (0.45) TGFBR1THRBMAPK14EGFRRAF1
SCHEMBL4868119 0.81 MAPK14 (0.60) TGFBR1THRBMAPK14EGFRRAF1
SCHEMBL4867464 0.80 MAPK14 (0.46) TGFBR1THRBMAPK14EGFRRAF1
SCHEMBL4862130 0.79 TGFBR1 (0.53) TGFBR1THRBMAPK14EGFRRAF1
SCHEMBL4873701 0.79 AKT1 (0.46) TGFBR1THRBMAPK14EGFRRAF1
SCHEMBL4868590 0.77 TGFBR1 (0.43) TGFBR1THRBMAPK14EGFRRAF1
SCHEMBL4868921 0.77 EGFR (0.40) TGFBR1THRBMAPK14EGFRRAF1
SCHEMBL4872159 0.77 TGFBR1 (0.55) TGFBR1THRBMAPK14EGFRRAF1

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
US-7365066-B2 Pyrazolopyridine derivatives as pharmaceutical agents ELI LILLY AND COMPANY (US) 2008-04-29 US claimed
US-7365066-B2 Pyrazolopyridine derivatives as pharmaceutical agents ELI LILLY AND COMPANY (US) 2008-04-29 US disclosed
EP-1543001-B1 PYRAZOLOPYRIDINE DERIVATIVES AS TGF BETA SIGNAL TRANSDUCTION INHIBITORS FOR THE TREATMENT OF CANCER LILLY CO ELI (US) 2007-08-15 EP disclosed
US-20050222197-A1 Novel pyrazolopyridine derivatives as pharmaceutical agents BEIGHT DOUGLAS W 2005-10-06 US disclosed
EP-1543001-A1 NOVEL PYRAZOLOPYRIDINE DERIVATIVES AS PHARMACEUTICAL AGENTS ELI LILLY AND COMPANY (US) 2005-06-22 EP disclosed
WO-2004026871-A1 NOVEL PYRAZOLOPYRIDINE DERIVATVES AS PHARMACEUTICAL AGENTS ELI LILLY AND COMPANY (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-20050222197-A1 Novel pyrazolopyridine derivatives as pharmaceutical agents TGFB2, TGFB1, TGFBR1 TGFBR1 3/4885THRB 176/4885MAPK14 106/4885

“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.