SCHEMBL5954582

SCHEMBL5954582

Cn1cc(-c2ccc3nnc(Cc4ccc5nc(NC(=O)C6CC6)cn5n4)n3c2)cn1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 11/20 0.48
DYRK1A Q13627 11/20 0.48
WNT1 P04628 9/20 0.48
ABL1 P00519 1/20 0.48
CSNK1D P48730 7/20 0.47
CSNK1E P49674 7/20 0.47
PIK3CG P48736 1/20 0.47

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
SCHEMBL5955483 0.90 CSNK1D (0.41) GSK3BDYRK1AWNT1ABL1CSNK1D
SCHEMBL5954813 0.89 GSK3B (0.42) GSK3BDYRK1AWNT1CSNK1DCSNK1E
SCHEMBL5955361 0.87 CCNC (0.44) GSK3BDYRK1AWNT1ABL1CSNK1D
SCHEMBL5954577 0.86 KDR (0.39) GSK3BDYRK1AWNT1CSNK1DCSNK1E
SCHEMBL5954459 0.84 CSNK1D (0.37) GSK3BDYRK1AWNT1ABL1CSNK1D
SCHEMBL13494551 0.83 CSNK1D (0.41) ABL1CSNK1DCSNK1E
SCHEMBL5954781 0.83 GSK3B (0.46) GSK3BDYRK1AWNT1ABL1CSNK1D
SCHEMBL5955358 0.82 MET (0.43) CSNK1DCSNK1E
SCHEMBL5954455 0.82 IGF1R (0.36) GSK3BDYRK1AWNT1CSNK1DCSNK1E
SCHEMBL5955093 0.82 CSNK1D (0.42) CSNK1DCSNK1E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2313407-B1 cMET INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2016-10-05 EP disclosed
EP-2313407-B1 cMET INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2016-10-05 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-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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-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.