SCHEMBL5082711

SCHEMBL5082711

COc1cc(/C=C2\C(=O)Nc3ccccc32)cc(Cl)c1O

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.84
PLK4 O00444 2/20 0.74
PLK1 P53350 2/20 0.74
RAF1 P04049 2/20 0.59
ERBB2 P04626 3/20 0.59
EGFR P00533 3/20 0.59
IGF1R P08069 2/20 0.59
PDGFRB P09619 1/20 0.59
NOX4 Q9NPH5 1/20 0.59
NPC1 O15118 1/20 0.57
CSNK1D P48730 3/20 0.57
CSNK1A1 P48729 2/20 0.57
CSNK1E P49674 2/20 0.57
LMNA P02545 2/20 0.57
MAPT P10636 2/20 0.57
HPGD P15428 2/20 0.57
MAPK1 P28482 2/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
GMNN O75496 1/20 0.57
ALDH1A1 P00352 1/20 0.57

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
SCHEMBL5082716 1.00 DHFR (0.84) DHFRPLK4PLK1RAF1ERBB2
SCHEMBL4727806 0.88 RAF1 (0.73) DHFRPLK4PLK1RAF1ERBB2
SCHEMBL5082831 0.88 RAF1 (0.73) DHFRPLK4PLK1RAF1ERBB2
SCHEMBL1394626 0.87 PLK4 (0.80) DHFRPLK4PLK1RAF1ERBB2
SCHEMBL1394624 0.87 PLK4 (0.80) DHFRPLK4PLK1RAF1ERBB2
SCHEMBL7979216 0.86 DHFR (0.84) DHFRPLK4PLK1RAF1ERBB2
SCHEMBL1395380 0.86 DHFR (0.84) DHFRPLK4PLK1RAF1ERBB2
SCHEMBL7979219 0.86 DHFR (0.84) DHFRPLK4PLK1RAF1ERBB2
SCHEMBL1395377 0.86 DHFR (0.84) DHFRPLK4PLK1RAF1ERBB2
SCHEMBL7979353 0.85 PLK4 (1.00) DHFRPLK4PLK1RAF1KMT2A

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-20080044390-A1 Methods and compositions for the treatment of neurodegenerative disorders CHDI, INCORPORATED 2008-02-21 US 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 DHFR 1017/4885PLK4 3482/4885PLK1 2516/4885

“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.