SCHEMBL4468876

SCHEMBL4468876

Cc1cc(=O)c(-c2ccc(CCc3ccc(C(F)(F)F)cc3)nc2)c(C)o1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.43
DAO P14920 4/20 0.41
BRD4 O60885 1/20 0.37
FGFR2 P21802 1/20 0.36
FGFR3 P22607 1/20 0.36
NR3C2 P08235 1/20 0.35
QPCT Q16769 1/20 0.35
PPARG P37231 1/20 0.35
PPARD Q03181 1/20 0.35
PPARA Q07869 1/20 0.35
MAOB P27338 1/20 0.34
RAB9A P51151 1/20 0.33
ESR1 P03372 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HTR2B P41595 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL4479235 0.89 SLC2A1 (0.42) PTGS2DAOBRD4NR3C2MAOB
SCHEMBL13761581 0.82 PTGS2 (0.48) PTGS2BRD4PPARAMAOBKDM4E
SCHEMBL4484283 0.80 DAO (0.44) PTGS2DAOFGFR2FGFR3RAB9A
SCHEMBL9259828 0.79 PTGS2 (0.61) PTGS2MAOB
SCHEMBL4481998 0.76 PTGS2 (0.43) PTGS2BRD4MAOBKDM4E
SCHEMBL4471452 0.73 KDM1A (0.44) PTGS2BRD4MAOBRAB9AKDM4E
SCHEMBL4480629 0.73 DAO (0.44) DAOFGFR2FGFR3MAOBRAB9A
SCHEMBL9268345 0.73 PTGS2 (0.55) PTGS2MAOB
SCHEMBL29160674 0.71 TAAR1 (0.44) DAOFGFR2FGFR3NR3C2MAOB
SCHEMBL4477921 0.70 DGAT1 (0.42)

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 6 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-7579353-B2 Pyridinone derivatives against malaria GLAXO GROUP LIMITED (GB) 2009-08-25 US disclosed
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
US-20080287461-A1 Pyridinone Derivatives Against Malaria GLAXO GROUP LIMITED (GB) 2008-11-20 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 1111/4885DAO 2428/4885BRD4 2655/4885

“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.