SCHEMBL14047458

SCHEMBL14047458

Cc1cc(C2CC(=O)Nc3c2ccc2ccccc32)cc(C(F)(F)F)c1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.56
ALDH1A1 P00352 2/20 0.56
TDP1 Q9NUW8 2/20 0.56
MAPK1 P28482 1/20 0.56
MAPT P10636 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
HTT P42858 1/20 0.54
KMT2A Q03164 1/20 0.52
HSD17B10 Q99714 1/20 0.51
IDO1 P14902 4/20 0.43
TP53 P04637 5/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
POLB P06746 1/20 0.38
GPBAR1 Q8TDU6 1/20 0.36

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
SCHEMBL10280293 0.88 LMNA (0.56) LMNAALDH1A1TDP1MAPK1MAPT
SCHEMBL880429 0.87 SMN1; SMN2 (0.64) LMNAALDH1A1TDP1MAPK1MAPT
SCHEMBL880490 0.84 LMNA (0.62) LMNAALDH1A1TDP1MAPK1MAPT
SCHEMBL880231 0.83 MAPT (0.68) LMNAALDH1A1TDP1MAPK1MAPT
SCHEMBL880388 0.81 LMNA (0.66) LMNAALDH1A1TDP1MAPK1MAPT
SCHEMBL13522427 0.78 HSD17B10 (0.53) LMNAALDH1A1TDP1MAPK1MAPT
SCHEMBL852442 0.78 LMNA (0.72) LMNAALDH1A1TDP1MAPK1MAPT
SCHEMBL880249 0.77 MAPT (0.58) LMNAALDH1A1TDP1MAPK1MAPT
SCHEMBL880302 0.77 LMNA (0.65) LMNAALDH1A1TDP1MAPK1MAPT
SCHEMBL14047471 0.77 LMNA (0.67) LMNAALDH1A1TDP1MAPK1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080261953-A1 Compounds, Compositions and Methods of Inhibiting Alpha-Synuclein Toxicity WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2008-10-23 US 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-20080261953-A1 Compounds, Compositions and Methods of Inhibiting Alpha-Synuclein Toxicity SNCA, PARK7, HTT LMNA 525/4885ALDH1A1 171/4885TDP1 556/4885

“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.