SCHEMBL4865701

SCHEMBL4865701

CCOC(=O)c1c(-c2cccc(C)n2)nn2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.55
KDM4E B2RXH2 8/20 0.43
ALDH1A1 P00352 9/20 0.43
MEN1 O00255 5/20 0.43
HPGD P15428 5/20 0.43
KMT2A Q03164 5/20 0.43
CYP1A2 P05177 4/20 0.43
CYP3A4 P08684 3/20 0.43
GAA P10253 3/20 0.43
CYP2C9 P11712 3/20 0.43
CYP2C19 P33261 3/20 0.43
CYP2D6 P10635 2/20 0.43
TGFBR1 P36897 2/20 0.43
MAPK1 P28482 2/20 0.43
MAPT P10636 3/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
ATM Q13315 1/20 0.41
NPSR1 Q6W5P4 2/20 0.41
PDE4D Q08499 2/20 0.41

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
SCHEMBL5231391 0.89 EGFR (0.53) EGFRKDM4EALDH1A1MEN1HPGD
SCHEMBL5235585 0.85 EGFR (0.56) EGFRKDM4EALDH1A1MEN1HPGD
SCHEMBL3271808 0.84 MIF (0.45) EGFRALDH1A1MEN1KMT2ACYP1A2
SCHEMBL4864274 0.84 MIF (0.45) EGFRALDH1A1MEN1KMT2ACYP1A2
SCHEMBL5232777 0.84 TGFBR1 (0.46) EGFRKDM4EALDH1A1MEN1HPGD
SCHEMBL13860649 0.82 EGFR (0.78) EGFRKDM4EALDH1A1MEN1HPGD
SCHEMBL5235429 0.81 ALDH1A1 (0.44) EGFRKDM4EALDH1A1MEN1HPGD
SCHEMBL5234607 0.81 TGFBR1 (0.43) EGFRKDM4EALDH1A1GAATGFBR1
SCHEMBL1780786 0.79 EGFR (0.53) EGFRKDM4EALDH1A1MEN1HPGD
SCHEMBL956204 0.79 EGFR (0.55) EGFRKDM4EALDH1A1MEN1HPGD

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 7 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 disclosed
US-7365066-B2 Pyrazolopyridine derivatives as pharmaceutical agents ELI LILLY AND COMPANY (US) 2008-04-29 US disclosed
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 EGFR 1392/4885KDM4E 4041/4885ALDH1A1 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.