SCHEMBL252764

SCHEMBL252764

COc1ccc(-c2ccc3nnc(C(C)c4ccc5nc(NC(=O)C6CC6)cn5n4)n3c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 2/20 0.51
PIK3CD O00329 1/20 0.44
PIK3CA P42336 1/20 0.44
PIK3CG P48736 1/20 0.44
KDR P35968 9/20 0.43
IKBKB O14920 1/20 0.42
RIPK2 O43353 1/20 0.42
JAK2 O60674 1/20 0.42
LCK P06239 1/20 0.42
TYK2 P29597 1/20 0.42
SYK P43405 1/20 0.42
GSK3B P49841 1/20 0.42
JAK3 P52333 1/20 0.42
PTK2B Q14289 1/20 0.42
CSNK1D P48730 7/20 0.42
CSNK1E P49674 7/20 0.42
MET P08581 3/20 0.41
ABL1 P00519 1/20 0.40
CSF1R P07333 1/20 0.40
YES1 P07947 1/20 0.40

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
SCHEMBL252205 0.92 PIK3CG (0.49) JAK1PIK3CGKDRJAK2PDGFRB
SCHEMBL252275 0.91 JAK1 (0.45) JAK1KDRCSNK1DCSNK1EMET
SCHEMBL251085 0.90 CSNK1D (0.54) KDRCSNK1DCSNK1E
SCHEMBL252807 0.89 KDR (0.41) JAK1PIK3CDPIK3CAPIK3CGKDR
SCHEMBL253082 0.88 CSNK1D (0.42) JAK1KDRJAK2TYK2CSNK1D
SCHEMBL5954809 0.88 CSNK1D (0.42) JAK1KDRCSNK1DCSNK1E
SCHEMBL251826 0.87 CSNK1D (0.42) JAK1PIK3CDPIK3CGKDRJAK2
SCHEMBL253186 0.87 JAK1 (0.43) JAK1KDRCSNK1DCSNK1E
SCHEMBL253560 0.87 CSNK1D (0.42) JAK1PIK3CGKDRJAK2TYK2
SCHEMBL252391 0.87 JAK1 (0.43) JAK1KDRGSK3BCSNK1DCSNK1E

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130315895-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-11-28 US disclosed
EP-2588107-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET Takeda Pharmaceutical Company Limited (JP) 2013-05-08 EP disclosed
US-8178534-B2 cMET inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-05-15 US disclosed
US-8178534-B2 cMET inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-05-15 US disclosed
US-8178534-B2 cMET inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-05-15 US disclosed
WO-2012003338-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-01-05 WO disclosed
WO-2012003338-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-01-05 WO disclosed
EP-2313407-A1 cMET INHIBITORS Takeda Pharmaceutical Company Limited (JP) 2011-04-27 EP disclosed
US-20100063054-A1 cMET INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-03-11 US disclosed
US-20100063054-A1 cMET INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-03-11 US disclosed
US-20100063054-A1 cMET INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-03-11 US disclosed
WO-2010019899-A1 cMET INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 WO disclosed
WO-2010019899-A1 cMET INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-18 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 (2 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-20130315895-A1 COMBINATION OF A cMET INHIBITOR AND AN ANTIBODY TO HGF AND/OR cMET HGF, MET, HGFAC JAK1 325/4885PIK3CD 3572/4885PIK3CA 2914/4885
US-20100063054-A1 cMET INHIBITORS CEPT1, LCAT, GNMT JAK1 396/4885PIK3CD 631/4885PIK3CA 543/4885

“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.