SCHEMBL4126598

SCHEMBL4126598

Cc1c(Sc2ccc(F)c(Cl)c2)cc(C(C)(C)C)c(O)c1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLRA3 O75311 1/20 0.43
GLRB P48167 1/20 0.43
RHEB Q15382 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.34
HIF1A Q16665 2/20 0.34
TP53 P04637 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
HTT P42858 2/20 0.33
DPP4 P27487 1/20 0.33
IDO1 P14902 1/20 0.33
TDO2 P48775 1/20 0.33
TYMS P04818 1/20 0.33
IGFBP3 P17936 1/20 0.32
MAPK13 O15264 1/20 0.32
MAPK12 P53778 1/20 0.32
MAPK11 Q15759 1/20 0.32
MAPK14 Q16539 1/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 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
SCHEMBL4117087 0.90 GLRA3 (0.47) GLRA3GLRBRHEBSMN1; SMN2HIF1A
SCHEMBL4127647 0.90 GLRA3 (0.47) GLRA3GLRBRHEBSMN1; SMN2HIF1A
SCHEMBL4121706 0.87 GLRA3 (0.49) GLRA3GLRBRHEBSMN1; SMN2HIF1A
SCHEMBL4121770 0.83 GLRA3 (0.50) GLRA3GLRBRHEBSMN1; SMN2HIF1A
SCHEMBL4128339 0.82 GLRA3 (0.51) GLRA3GLRBSMN1; SMN2HIF1ATP53
SCHEMBL4127853 0.81 GLRA3 (0.40) GLRA3GLRBSMN1; SMN2HTTTYMS
SCHEMBL4122301 0.81 GLRA3 (0.44) GLRA3GLRBSMN1; SMN2HIF1ATP53
SCHEMBL4129099 0.80 GLRA3 (0.53) GLRA3GLRBSMN1; SMN2HIF1ATP53
SCHEMBL4113656 0.80 GLRA3 (0.47) GLRA3GLRBSMN1; SMN2HIF1ATP53
SCHEMBL4129271 0.80 GLRA3 (0.47) GLRA3GLRBSMN1; SMN2HIF1ATP53

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090192190-A1 Benzoic Acid Derivatives that are Modulators or Agonists of GlyR ASTRAZENECA AB (SE) 2009-07-30 US disclosed
EP-1890993-A2 BENZOIC ACID DERIVATIVES THAT ARE MODULATORS OR ANTAGONISTS OF GLYR AstraZeneca AB (SE) 2008-02-27 EP disclosed
WO-2006121390-A2 BENZOIC ACID DERIVATIVES THAT ARE MODULATORS OR AGONISTS OF GLYR ASTRAZENECA AB (SE) 2006-11-16 WO 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-20090192190-A1 Benzoic Acid Derivatives that are Modulators or Agonists of GlyR GLRA1, GLRB, GPBAR1 GLRA3 6/4885GLRB 2/4885RHEB 3735/4885

“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.