SCHEMBL4872336

SCHEMBL4872336

CCOc1ccc2c(-c3c(-c4ccccn4)nn4ccccc34)ccnc2c1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 19/20 0.51
THRB P10828 3/20 0.50
MAPK14 Q16539 3/20 0.50
TGFBR2 P37173 1/20 0.47
GRM4 Q14833 1/20 0.46

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
SCHEMBL14198366 0.92 TGFBR1 (0.55) TGFBR1THRBMAPK14TGFBR2
SCHEMBL4867319 0.90 TGFBR1 (0.48) TGFBR1THRBMAPK14TGFBR2GRM4
SCHEMBL4864349 0.89 TGFBR1 (0.65) TGFBR1THRBMAPK14TGFBR2GRM4
SCHEMBL4872902 0.89 TGFBR1 (0.65) TGFBR1THRBMAPK14TGFBR2
SCHEMBL4871905 0.89 TGFBR1 (0.60) TGFBR1THRBMAPK14TGFBR2
SCHEMBL407982 0.88 TGFBR1 (0.60) TGFBR1THRBMAPK14TGFBR2
SCHEMBL4868276 0.88 TGFBR1 (0.53) TGFBR1THRBMAPK14TGFBR2GRM4
SCHEMBL413616 0.88 TGFBR1 (0.64) TGFBR1TGFBR2
SCHEMBL411839 0.88 TGFBR1 (0.67) TGFBR1THRBMAPK14TGFBR2
SCHEMBL4872764 0.88 TGFBR1 (0.59) TGFBR1THRBMAPK14TGFBR2

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 2 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
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