SCHEMBL14198366

SCHEMBL14198366

CCCCOc1ccc2c(-c3c(-c4ccccn4)nn4ccccc34)ccnc2c1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 20/20 0.55
TGFBR2 P37173 1/20 0.49
THRB P10828 3/20 0.44
MAPK14 Q16539 3/20 0.44

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
SCHEMBL4871905 0.93 TGFBR1 (0.60) TGFBR1TGFBR2THRBMAPK14
SCHEMBL4872336 0.92 TGFBR1 (0.51) TGFBR1TGFBR2THRBMAPK14
SCHEMBL413616 0.92 TGFBR1 (0.64) TGFBR1TGFBR2
SCHEMBL4872764 0.91 TGFBR1 (0.59) TGFBR1TGFBR2THRBMAPK14
SCHEMBL16296983 0.91 TGFBR1 (0.53) TGFBR1TGFBR2THRBMAPK14
SCHEMBL4872902 0.91 TGFBR1 (0.65) TGFBR1TGFBR2THRBMAPK14
SCHEMBL413261 0.90 TGFBR1 (0.63) TGFBR1TGFBR2THRBMAPK14
SCHEMBL407982 0.90 TGFBR1 (0.60) TGFBR1TGFBR2THRBMAPK14
SCHEMBL411839 0.90 TGFBR1 (0.67) TGFBR1TGFBR2THRBMAPK14
SCHEMBL4867319 0.88 TGFBR1 (0.48) TGFBR1TGFBR2THRBMAPK14

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 1 patent. 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