SCHEMBL2596757

SCHEMBL2596757

OCC(O)Cn1cc2nccc(Nc3ccnc(-c4cc(Cl)ccc4F)c3)c2n1

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 20/20 0.71
CYP3A4 P08684 1/20 0.71

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
SCHEMBL2596975 1.00 TGFBR1 (0.71) TGFBR1CYP3A4
SCHEMBL2596756 1.00 TGFBR1 (0.71) TGFBR1CYP3A4
SCHEMBL2596868 0.84 TGFBR1 (0.73) TGFBR1CYP3A4
SCHEMBL2596933 0.84 TGFBR1 (0.73) TGFBR1CYP3A4
SCHEMBL2596881 0.83 TGFBR1 (0.73) TGFBR1CYP3A4
SCHEMBL2596760 0.83 TGFBR1 (0.51) TGFBR1CYP3A4
SCHEMBL2596799 0.83 TGFBR1 (1.00) TGFBR1CYP3A4
SCHEMBL2596746 0.82 TGFBR1 (0.88) TGFBR1CYP3A4
SCHEMBL2596782 0.81 TGFBR1 (0.69) TGFBR1CYP3A4
SCHEMBL2596800 0.80 TGFBR1 (0.68) TGFBR1CYP3A4

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
WO-2011146287-A1 PYRAZOLO[4,3-B]PYRIDINE-7-AMINE INHIBITORS OF ALK5 TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-11-24 WO claimed
WO-2011146287-A1 PYRAZOLO[4,3-B]PYRIDINE-7-AMINE INHIBITORS OF ALK5 TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-11-24 WO disclosed