SCHEMBL4486777

SCHEMBL4486777

Cc1cc(=O)c(-c2c[nH]c(-c3cccc(C(F)(F)F)c3)cc2=O)c(C)[nH]1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SCN2A Q99250 3/20 0.40
MAPT P10636 2/20 0.40
IKBKB O14920 1/20 0.39
PIN1 Q13526 1/20 0.39
XDH P47989 1/20 0.39
SLC11A2 P49281 1/20 0.38
MAPK14 Q16539 1/20 0.37
NPY5R Q15761 1/20 0.37
CDC7 O00311 1/20 0.36
GRIN1 Q05586 2/20 0.36
GRIN2B Q13224 2/20 0.36
MAOB P27338 1/20 0.36
PARP1 P09874 1/20 0.35

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
SCHEMBL4493394 0.84 SLC2A1 (0.52) SCN2AMAPTIKBKBPIN1XDH
SCHEMBL4492022 0.84 MAPT (0.41) SCN2AMAPTIKBKBPIN1XDH
SCHEMBL5096521 0.79 DAO (0.52) MAPT
SCHEMBL4486775 0.75 SLC2A1 (0.46) SCN2AMAPTIKBKBPIN1XDH
SCHEMBL3395826 0.74 CSF1R (0.33) GRIN1GRIN2B
SCHEMBL4484287 0.73 DAO (0.49) MAPT
SCHEMBL4480239 0.73 BRD4 (0.47) MAPT
SCHEMBL4470829 0.72 MAPT (0.39) MAPT
SCHEMBL4565035 0.71 TNKS (0.39) MAPTSLC11A2NPY5RMAOBPARP1
SCHEMBL4483281 0.71 SLC2A1 (0.44) IKBKB

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 SCN2A 3429/4885MAPT 1942/4885IKBKB 3664/4885

“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.