SCHEMBL251105

SCHEMBL251105

COCCn1cc(-c2ccc3nnc(Sc4ccc5nc(NC(=O)C6CC6)cn5n4)n3c2)cn1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.41
DYRK1A Q13627 2/20 0.41
WNT1 P04628 1/20 0.41
CSNK1D P48730 5/20 0.41
CSNK1E P49674 5/20 0.41
MET P08581 7/20 0.40
PDE3B Q13370 2/20 0.40
PDE3A Q14432 2/20 0.40
KDR P35968 4/20 0.40
CTSK P43235 2/20 0.39
CTSC P53634 2/20 0.39
RIPK1 Q13546 1/20 0.37

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
SCHEMBL2746883 0.93 CSNK1D (0.39) CSNK1DCSNK1EMETPDE3BPDE3A
SCHEMBL252697 0.93 KDR (0.39) GSK3BDYRK1AWNT1CSNK1DCSNK1E
SCHEMBL2748206 0.91 MET (0.47) GSK3BDYRK1AWNT1CSNK1DCSNK1E
SCHEMBL252249 0.89 GSK3B (0.47) GSK3BDYRK1AWNT1CSNK1DCSNK1E
SCHEMBL253861 0.86 CCNC (0.44) CSNK1DCSNK1EMETPDE3BPDE3A
SCHEMBL5954813 0.85 GSK3B (0.42) GSK3BDYRK1AWNT1CSNK1DCSNK1E
SCHEMBL5955234 0.85 CSNK1D (0.42) CSNK1DCSNK1EMETKDRRIPK1
SCHEMBL5955382 0.85 CSNK1D (0.37) CSNK1DCSNK1EMETPDE3BPDE3A
SCHEMBL5955226 0.84 CSNK1D (0.40) CSNK1DCSNK1EMETKDRRIPK1
SCHEMBL5954580 0.84 GSK3B (0.41) GSK3BDYRK1AWNT1CSNK1DCSNK1E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8178534-B2 cMET inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-05-15 US claimed
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 GSK3B 576/4885DYRK1A 2985/4885WNT1 632/4885
US-20100063054-A1 cMET INHIBITORS CEPT1, LCAT, GNMT GSK3B 35/4885DYRK1A 4332/4885WNT1 2494/4885

“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.