SCHEMBL1007256

SCHEMBL1007256

O=C(Cn1nc(C(F)(F)F)c2c1CCCC2)NCc1cccc(Cl)c1

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.72
TP53 P04637 5/20 0.72
LMNA P02545 2/20 0.72
SMN1; SMN2 Q16637 1/20 0.66
THRB P10828 2/20 0.61
POLB P06746 2/20 0.59
TDP1 Q9NUW8 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2C19 P33261 1/20 0.56
TSHR P16473 1/20 0.53

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
SCHEMBL1007309 0.90 SMN1; SMN2 (0.76) MAPTTP53LMNASMN1; SMN2THRB
SCHEMBL1895893 0.89 SMN1; SMN2 (0.67) MAPTTP53LMNASMN1; SMN2THRB
SCHEMBL1005976 0.89 SMN1; SMN2 (0.78) MAPTTP53LMNASMN1; SMN2THRB
SCHEMBL1007781 0.88 MAPT (0.74) MAPTTP53LMNASMN1; SMN2THRB
SCHEMBL1007554 0.88 SMN1; SMN2 (0.68) MAPTTP53LMNASMN1; SMN2POLB
SCHEMBL1007727 0.88 SMN1; SMN2 (0.68) MAPTTP53LMNASMN1; SMN2THRB
SCHEMBL1007522 0.88 SMN1; SMN2 (0.76) MAPTTP53LMNASMN1; SMN2POLB
SCHEMBL1895812 0.86 SMN1; SMN2 (0.68) MAPTTP53LMNASMN1; SMN2THRB
SCHEMBL1894039 0.86 SMN1; SMN2 (0.70) MAPTTP53LMNASMN1; SMN2POLB
SCHEMBL1006458 0.86 SMN1; SMN2 (0.79) MAPTTP53LMNASMN1; SMN2POLB

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 4623/4885TP53 3973/4885LMNA 4015/4885

“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.