SCHEMBL11902297

SCHEMBL11902297

CCOCCOC(=O)c1nc(-c2ccc(Cl)c(OC)c2F)cc2[nH]cc(C)c12

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PTGES O14684 6/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MEP1B Q16820 1/20 0.32
▸ PTGDR Q13258 1/20 0.31
▸ JAK2 O60674 1/20 0.31
▸ JAK3 P52333 1/20 0.31
▸ MTNR1A P48039 1/20 0.31
▸ MTNR1B P49286 1/20 0.31
▸ GLP1R P43220 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
SCHEMBL1656974 0.94 GLP1R (0.35) SMN1; SMN2ALDH1A1MEP1BPTGDRJAK2
SCHEMBL11913427 0.93 SMN1; SMN2 (0.37) PTGESSMN1; SMN2ALDH1A1
SCHEMBL11903304 0.93 ABCB11 (0.34) PTGESSMN1; SMN2ALDH1A1MEP1BMTNR1A
SCHEMBL1654723 0.88 NR4A2 (0.36) MEP1B
SCHEMBL11903307 0.87 PTGES (0.32) PTGESSMN1; SMN2MEP1B
SCHEMBL11902410 0.86 SMN1; SMN2 (0.34) PTGESSMN1; SMN2ALDH1A1MEP1BJAK2
SCHEMBL11903206 0.86 PKM (0.35) PTGESSMN1; SMN2L3MBTL1ALDH1A1MEP1B
SCHEMBL11902585 0.85 DHODH (0.39) SMN1; SMN2L3MBTL1
SCHEMBL11902294 0.84 PTGES (0.33) PTGESMEP1B
SCHEMBL11902825 0.84 KMO (0.43) ALDH1A1MEP1B

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-20120202690-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (US) 2012-08-09 — — US disclosed
US-20120202690-A1 HERBICIDAL COMPOUNDS SYNGENTA LIMITED (US) 2012-08-09 — — 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-20120202690-A1 HERBICIDAL COMPOUNDS DDT, HAO2, HAAO PTGES 1440/4885SMN1; SMN2 3709/4885L3MBTL1 2005/4885

“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.

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