SCHEMBL5086182

SCHEMBL5086182

O=C1Nc2ccc(OC(F)(F)F)cc2/C1=C/c1cc(I)c(O)c(I)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 3/20 0.60
LRRK2 Q5S007 4/20 0.57
CES1 P23141 1/20 0.54
RAF1 P04049 4/20 0.52
MAP1LC3B Q9GZQ8 3/20 0.52
EGFR P00533 3/20 0.52
PLK4 O00444 2/20 0.52
LMNA P02545 2/20 0.52
MAPT P10636 2/20 0.52
PLK1 P53350 2/20 0.52
NTRK1 P04629 1/20 0.52
ARAF P10398 1/20 0.52
PIM1 P11309 1/20 0.52
BRAF P15056 1/20 0.52
CSNK2A1 P68400 1/20 0.52
PIM3 Q86V86 1/20 0.52
SIRT2 Q8IXJ6 1/20 0.52
SIRT1 Q96EB6 1/20 0.52
MYOC Q99972 1/20 0.52
DYRK4 Q9NR20 1/20 0.52

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
SCHEMBL1394877 1.00 RET (0.60) RETLRRK2CES1RAF1MAP1LC3B
SCHEMBL1394515 0.86 RAF1 (0.60) RETLRRK2CES1RAF1MAP1LC3B
SCHEMBL1395239 0.86 LRRK2 (0.73) RETLRRK2CES1RAF1MAP1LC3B
SCHEMBL5083186 0.86 LRRK2 (0.73) RETLRRK2CES1RAF1MAP1LC3B
SCHEMBL4728586 0.86 RAF1 (0.60) RETLRRK2CES1RAF1MAP1LC3B
SCHEMBL1394501 0.82 LRRK2 (0.70) RETLRRK2RAF1MAP1LC3BEGFR
SCHEMBL1394503 0.82 LRRK2 (0.70) RETLRRK2RAF1MAP1LC3BEGFR
SCHEMBL6690796 0.80 RAF1 (0.76) LRRK2RAF1MAP1LC3BEGFRPLK4
SCHEMBL4730059 0.80 RET (0.55) RETLRRK2CES1RAF1MAP1LC3B
SCHEMBL1395237 0.80 LRRK2 (0.61) RETLRRK2RAF1MAP1LC3BEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080044390-A1 Methods and compositions for the treatment of neurodegenerative disorders CHDI, INCORPORATED 2008-02-21 US disclosed
EP-1003721-B1 BENZYLIDENE-1,3-DIHYDRO-INDOL-2-ONE DERIVATIVES AS RECEPTOR TYROSINE KINASE INHIBITORS, PARTICULARLY OF RAF KINASES GLAXO GROUP LTD (GB) 2006-11-02 EP disclosed
US-6268391-B1 Benzylidene-1,3-dihydro-indol-2-one derivatives a receptor tyrosine kinase inhibitors, particularly of Raf kinases GLAXO WELLCOME INC. 2001-07-31 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-20080044390-A1 Methods and compositions for the treatment of neurodegenerative disorders HTT, SNCA, NLN RET 3696/4885LRRK2 408/4885CES1 2952/4885

“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.