SCHEMBL4472791

SCHEMBL4472791

Cc1[nH]c(C)c(-c2c[nH]c(-c3ccc(C(F)(F)F)cc3)cc2=O)c(=O)c1Br

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.46
TRPV1 Q8NER1 1/20 0.34
DAO P14920 1/20 0.34
PARP1 P09874 1/20 0.34
TNKS O95271 1/20 0.34
PTGS2 P35354 1/20 0.34
TDP2 O95551 1/20 0.33
RAB9A P51151 1/20 0.33
MAPT P10636 2/20 0.33
CTSS P25774 1/20 0.33
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CCNB2 O95067 1/20 0.32
CDK1 P06493 1/20 0.32
CCNB1 P14635 1/20 0.32
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
CCNB3 Q8WWL7 1/20 0.32
NPY5R Q15761 1/20 0.32

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
SCHEMBL4483281 0.91 SLC2A1 (0.44) SLC2A1
SCHEMBL4493394 0.89 SLC2A1 (0.52) SLC2A1MAPTALDH1A1SMN1; SMN2NPY5R
SCHEMBL4464654 0.87 ADORA2A (0.39) SLC2A1PTGS2RAB9AMAPTALDH1A1
SCHEMBL4476392 0.87 SLC2A1 (0.43) SLC2A1DAOTDP2MAPT
SCHEMBL4565035 0.86 TNKS (0.39) SLC2A1DAOPARP1TNKSPTGS2
SCHEMBL4490476 0.85 SLC2A1 (0.38) SLC2A1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL4480435 0.85 SLC2A1 (0.40) SLC2A1DAOPTGS2
SCHEMBL4487870 0.84 SLC2A1 (0.40) SLC2A1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL4487288 0.82 PTGS2 (0.39) SLC2A1PTGS2
SCHEMBL4489339 0.82 SLC2A1 (0.41) SLC2A1TRPV1DAONPY5R

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 4 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 claimed
US-20080287461-A1 Pyridinone Derivatives Against Malaria GLAXO GROUP LIMITED (GB) 2008-11-20 US claimed
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 SLC2A1 2278/4885TRPV1 4142/4885DAO 2428/4885

“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.