SCHEMBL1007299

SCHEMBL1007299

Cc1nn(C)c(C)c1NC(=O)Cn1nc(C(F)(F)F)c2c1CCCC2

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.66
ALDH1A1 P00352 2/20 0.64
SMN1; SMN2 Q16637 2/20 0.62
TP53 P04637 2/20 0.61
CYP1A2 P05177 1/20 0.60
CYP3A4 P08684 1/20 0.60
CYP2C19 P33261 1/20 0.60
LMNA P02545 3/20 0.60
POLB P06746 1/20 0.59
TSHR P16473 2/20 0.58
TDP1 Q9NUW8 1/20 0.58
THRB P10828 1/20 0.58
GAA P10253 1/20 0.57
HSD17B10 Q99714 1/20 0.57

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
SCHEMBL1008520 0.88 MAPT (0.64) MAPTALDH1A1SMN1; SMN2TP53CYP1A2
SCHEMBL1894438 0.82 MAPT (0.65) MAPTALDH1A1SMN1; SMN2TP53CYP1A2
SCHEMBL1894400 0.80 MAPT (0.67) MAPTALDH1A1SMN1; SMN2TP53CYP1A2
SCHEMBL1007707 0.78 POLB (0.81) MAPTSMN1; SMN2TP53CYP1A2CYP3A4
SCHEMBL1004180 0.78 MAPT (0.55) MAPTALDH1A1SMN1; SMN2TP53CYP1A2
SCHEMBL12666730 0.77 ALDH1A1 (0.69) MAPTALDH1A1SMN1; SMN2TP53CYP1A2
SCHEMBL1898267 0.76 SMN1; SMN2 (0.65) MAPTALDH1A1SMN1; SMN2TP53CYP1A2
SCHEMBL1007770 0.76 MAPT (0.61) MAPTALDH1A1SMN1; SMN2TP53CYP1A2
SCHEMBL12379943 0.76 LMNA (0.76) MAPTALDH1A1SMN1; SMN2TP53CYP1A2
SCHEMBL1008136 0.76 POLB (0.61) MAPTSMN1; SMN2TP53CYP1A2CYP3A4

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 6 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
US-20110118236-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-05-19 US disclosed
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 4623/4885ALDH1A1 614/4885SMN1; SMN2 3616/4885

“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.