SCHEMBL4483764

SCHEMBL4483764

Cc1cc(=O)c(-c2ccc(C#Cc3ccc(F)cc3F)nc2)c(C)o1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 11/20 0.40
PTGS1 P23219 2/20 0.34
GRM5 P41594 2/20 0.33
NR3C2 P08235 1/20 0.32
TRPV3 Q8NET8 1/20 0.31
ACACB O00763 1/20 0.31
PTPRC P08575 1/20 0.31
PTPN2 P17706 1/20 0.31
PTPN1 P18031 1/20 0.31
PTPN6 P29350 1/20 0.31
PTPN9 P43378 1/20 0.31
DUSP3 P51452 1/20 0.31
PTPN11 Q06124 1/20 0.31
PTPN22 Q9Y2R2 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.31

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
SCHEMBL4481998 0.77 PTGS2 (0.43) PTGS2ACACBPTPN1PTGDR2
SCHEMBL4469249 0.74 GRM5 (0.44) PTGS2GRM5
SCHEMBL4475703 0.74 PTGES (0.35) GRM5NR3C2TRPV3ACACBPTGDR2
SCHEMBL9271064 0.73 PTGS2 (0.58) PTGS2PTGS1
SCHEMBL9267689 0.72 PTGS2 (0.57) PTGS2
SCHEMBL4481069 0.70 TP53 (0.36) PTGS2PTGS1
SCHEMBL4480186 0.68 TDP1 (0.42)
SCHEMBL13754677 0.67 PTGS2 (0.44) PTGS2
SCHEMBL9264843 0.67 PTGS2 (0.52) PTGS2PTGS1
SCHEMBL4485765 0.66 MAPT (0.37) PTGS2PTPN1

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-7579353-B2 Pyridinone derivatives against malaria GLAXO GROUP LIMITED (GB) 2009-08-25 US disclosed
US-20080287461-A1 Pyridinone Derivatives Against Malaria GLAXO GROUP LIMITED (GB) 2008-11-20 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-20080287461-A1 Pyridinone Derivatives Against Malaria G6PD, PNPO, PLPBP PTGS2 1111/4885PTGS1 594/4885GRM5 1948/4885

“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.