SCHEMBL1243101

SCHEMBL1243101

Cc1nc(CCNC(=O)c2ccccc2C(F)(F)F)cs1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.65
TP53 P04637 5/20 0.59
SMN1; SMN2 Q16637 4/20 0.58
NPC1 O15118 1/20 0.58
ALDH1A1 P00352 1/20 0.58
RAB9A P51151 1/20 0.58
GAA P10253 2/20 0.53
HTT P42858 1/20 0.53
ATM Q13315 1/20 0.52
LMNA P02545 2/20 0.51
KDM4E B2RXH2 1/20 0.51
NAMPT P43490 1/20 0.49
HIF1A Q16665 1/20 0.49
HSD17B10 Q99714 1/20 0.47
POLB P06746 2/20 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
SCHEMBL1243075 0.84 ATM (0.74) MAPTTP53SMN1; SMN2ALDH1A1ATM
SCHEMBL15401571 0.83 TP53 (0.57) MAPTTP53SMN1; SMN2NPC1ALDH1A1
SCHEMBL1243710 0.82 MAPT (0.69) MAPTTP53SMN1; SMN2NPC1ALDH1A1
SCHEMBL1243700 0.79 TP53 (0.72) MAPTTP53ALDH1A1GAALMNA
SCHEMBL3244453 0.77 TP53 (0.50) MAPTTP53SMN1; SMN2GAAATM
SCHEMBL1243071 0.76 SMN1; SMN2 (0.69) MAPTSMN1; SMN2NPC1ALDH1A1RAB9A
SCHEMBL31452997 0.74 LMNA (0.57) MAPTTP53SMN1; SMN2ALDH1A1GAA
SCHEMBL13073725 0.74 NPC1 (0.66) MAPTTP53SMN1; SMN2NPC1ALDH1A1
SCHEMBL16771871 0.74 TP53 (0.62) MAPTTP53SMN1; SMN2ALDH1A1GAA
SCHEMBL6360854 0.74 LMNA (0.60) TP53ALDH1A1GAAHTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7888289-B2 2,6-Difluoro-N-[2-(2-methyl-4-thiazolyl)ethyl]benzamide; applying an effective and nonphytotoxic amount of the fungicide composition to the plant seeds,leaves and/or fruits of the plants or to the soil; crops; Alternaria BAYER CROPSCIENCE AG (DE) 2011-02-15 US claimed
US-20090156651-A1 Heterocyclylethylbenzamide Derivatives BAYER INTELLECTUAL PROPERTY GMBH (DE) 2009-06-18 US claimed
EP-1871744-B1 NEW HETEROCYCLYLETHYLBENZAMIDE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2009-01-07 EP claimed
EP-1871744-A1 NEW HETEROCYCLYLETHYLBENZAMIDE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2008-01-02 EP claimed
WO-2006108792-A1 NEW HETEROCYCLYLETHYLBENZAMIDE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2006-10-19 WO claimed
US-7888289-B2 2,6-Difluoro-N-[2-(2-methyl-4-thiazolyl)ethyl]benzamide; applying an effective and nonphytotoxic amount of the fungicide composition to the plant seeds,leaves and/or fruits of the plants or to the soil; crops; Alternaria BAYER CROPSCIENCE AG (DE) 2011-02-15 US disclosed
US-20090156651-A1 Heterocyclylethylbenzamide Derivatives BAYER INTELLECTUAL PROPERTY GMBH (DE) 2009-06-18 US disclosed
EP-1871744-B1 NEW HETEROCYCLYLETHYLBENZAMIDE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2009-01-07 EP disclosed
EP-1871744-A1 NEW HETEROCYCLYLETHYLBENZAMIDE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2008-01-02 EP disclosed
WO-2006108792-A1 NEW HETEROCYCLYLETHYLBENZAMIDE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2006-10-19 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-20090156651-A1 Heterocyclylethylbenzamide Derivatives CYP1A2, CYP51A1, CYP1B1 MAPT 2385/4885TP53 3468/4885SMN1; SMN2 3511/4885

“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.