SCHEMBL1006933

SCHEMBL1006933

O=C(Cn1nc(C(F)(F)F)c2c1CCCC2)n1[nH]c(=O)c2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.57
TSHR P16473 2/20 0.56
GAA P10253 2/20 0.56
NPSR1 Q6W5P4 1/20 0.56
KCNJ2 P63252 1/20 0.56
POLQ O75417 1/20 0.53
POLB P06746 3/20 0.51
HSD17B10 Q99714 1/20 0.49
MAPT P10636 4/20 0.49
TP53 P04637 3/20 0.49
ALOX15 P16050 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL1008435 0.74 LMNA (1.00) LMNATSHRGAANPSR1POLQ
SCHEMBL15708803 0.73 LMNA (1.00) LMNATSHRGAANPSR1POLQ
SCHEMBL20371480 0.73 LMNA (1.00) LMNATSHRGAANPSR1POLQ
SCHEMBL1007522 0.72 SMN1; SMN2 (0.76) LMNATSHRGAANPSR1POLQ
SCHEMBL20142742 0.71 KCNJ2 (1.00) LMNATSHRGAANPSR1KCNJ2
SCHEMBL1006167 0.71 LMNA (0.94) LMNATSHRGAANPSR1POLQ
SCHEMBL12379943 0.70 LMNA (0.76) LMNATSHRGAANPSR1POLQ
SCHEMBL1008020 0.70 SMN1; SMN2 (0.76) LMNATSHRPOLBMAPTTP53
SCHEMBL1006932 0.70 POLB (0.77) LMNATSHRGAANPSR1KCNJ2
SCHEMBL1006501 0.70 POLQ (1.00) LMNATSHRGAANPSR1KCNJ2

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 2 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

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 LMNA 4015/4885TSHR 134/4885GAA 4077/4885

“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.