SCHEMBL4865446

SCHEMBL4865446

CCOC(=O)c1ccc2c(-c3ccc(F)cc3)c(-c3cccc(C)n3)nn2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 3/20 0.53
THRB P10828 1/20 0.45
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 2/20 0.44
HPGD P15428 2/20 0.44
LMNA P02545 1/20 0.44
MAPK14 Q16539 2/20 0.41
CSNK1A1 P48729 1/20 0.41
CSNK1D P48730 1/20 0.41
CSNK1E P49674 1/20 0.41
ELANE P08246 2/20 0.41
GABRA2 P47869 1/20 0.41
GABRB2 P47870 1/20 0.41
ALOX5 P09917 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
GRM5 P41594 1/20 0.39
MAPT P10636 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL4873313 0.87 TGFBR1 (0.51) TGFBR1THRBMAPK14CSNK1A1CSNK1D
SCHEMBL30944261 0.82 MAPK14 (0.64) ALDH1A1KDM4EHPGDLMNAMAPK14
SCHEMBL4868672 0.81 TGFBR1 (0.49) TGFBR1THRBALDH1A1KDM4EHPGD
SCHEMBL413509 0.80 TGFBR1 (0.47) TGFBR1THRBHPGD
SCHEMBL414625 0.80 TGFBR1 (0.49) TGFBR1THRBMAPK14CSNK1A1CSNK1D
SCHEMBL4874607 0.78 TGFBR1 (0.52) TGFBR1THRBMAPK14CSNK1A1CSNK1D
SCHEMBL4869716 0.77 PTGS2 (0.53) TGFBR1THRBMAPK14CSNK1A1CSNK1D
SCHEMBL5234295 0.75 TGFBR1 (0.39) TGFBR1THRBMAPK14CSNK1A1CSNK1D
SCHEMBL4868119 0.74 MAPK14 (0.60) TGFBR1THRBMAPK14CSNK1A1CSNK1D
SCHEMBL5232777 0.74 TGFBR1 (0.46) TGFBR1ALDH1A1KDM4EHPGDLMNA

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 176/4885ALDH1A1 1975/4885

“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.