SCHEMBL254198

SCHEMBL254198

CC(c1ccc2nc(NC(=O)C3CC3)cn2n1)c1nnc2ccc(-c3cccc(C(N)=O)c3)cn12

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 10/20 0.42
RIPK1 Q13546 1/20 0.41
AAK1 Q2M2I8 1/20 0.40
CSNK1D P48730 4/20 0.40
CSNK1E P49674 4/20 0.40
BRAF P15056 1/20 0.40
JAK1 P23458 2/20 0.40
PIK3CG P48736 2/20 0.39
PIK3CD O00329 1/20 0.39
AURKA O14965 1/20 0.38
PDGFRB P09619 1/20 0.38
KIT P10721 1/20 0.38
FLT1 P17948 1/20 0.38

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
SCHEMBL253082 0.92 CSNK1D (0.42) KDRRIPK1AAK1CSNK1DCSNK1E
SCHEMBL253291 0.89 RIPK1 (0.49) KDRRIPK1CSNK1DCSNK1EBRAF
SCHEMBL252774 0.87 KDR (0.42) KDRRIPK1CSNK1DCSNK1EJAK1
SCHEMBL252205 0.87 PIK3CG (0.49) KDRBRAFJAK1PIK3CGAURKA
SCHEMBL252525 0.87 PIK3CD (0.49) KDRRIPK1CSNK1DCSNK1EJAK1
SCHEMBL253704 0.87 JAK1 (0.44) KDRRIPK1CSNK1DCSNK1EJAK1
SCHEMBL251085 0.85 CSNK1D (0.54) KDRRIPK1CSNK1DCSNK1EBRAF
SCHEMBL253560 0.85 CSNK1D (0.42) KDRRIPK1CSNK1DCSNK1EJAK1
SCHEMBL252743 0.84 GSK3B (0.46) CSNK1DCSNK1EPIK3CG
SCHEMBL5954809 0.84 CSNK1D (0.42) KDRRIPK1CSNK1DCSNK1EJAK1

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 KDR 142/4885RIPK1 2019/4885AAK1 2765/4885
US-20100063054-A1 cMET INHIBITORS CEPT1, LCAT, GNMT KDR 1387/4885RIPK1 2871/4885AAK1 3228/4885

“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.