SCHEMBL1007250

SCHEMBL1007250

CC(NC(=O)Cn1nc(C(F)(F)F)c2c1CNCC2)c1ccc(Cl)cc1

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.52
TP53 P04637 5/20 0.52
THRB P10828 2/20 0.52
LMNA P02545 1/20 0.48
POLB P06746 1/20 0.47
GPR139 Q6DWJ6 9/20 0.46

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
SCHEMBL12674152 0.93 MAPT (0.53) MAPTTP53GPR139
SCHEMBL1006951 0.93 MAPT (0.52) MAPTTP53THRBLMNAPOLB
SCHEMBL1896530 0.86 MAPT (0.69) MAPTTP53THRBLMNAPOLB
SCHEMBL12674413 0.85 MAPT (0.53) MAPTTP53GPR139
SCHEMBL8000803 0.83 MAPT (0.52) MAPTTP53THRBLMNAPOLB
SCHEMBL1008079 0.81 MAPT (0.50) MAPTTP53THRBLMNAPOLB
SCHEMBL1007964 0.81 MAPT (0.52) MAPTTP53THRBLMNAPOLB
SCHEMBL1007958 0.80 MAPT (0.50) MAPTTP53THRBLMNAPOLB
SCHEMBL1895725 0.78 MAPT (0.47) MAPTTP53THRBLMNAPOLB
SCHEMBL1007018 0.78 MAPT (0.78) MAPTTP53THRBLMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110118236-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-05-19 US disclosed
EP-2269990-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2011-01-05 EP disclosed
EP-2269990-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2011-01-05 EP disclosed
WO-2009119088-A1 HETEROCYCLIC COMPOUND 武田薬品工業株式会社 (JP) 2009-10-01 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-20110118236-A1 HETEROCYCLIC COMPOUND GRIN1, GRM1, GRIK1 MAPT 4623/4885TP53 3973/4885THRB 496/4885

“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.