SCHEMBL10035229

SCHEMBL10035229

Cc1nn(C)c(O)c1C(=O)c1ccc(S(C)(=O)=O)c(C)c1C

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.31
MAPT P10636 2/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
NR2F2 P24468 1/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
POLB P06746 1/20 0.30
SPR P35270 1/20 0.30

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
SCHEMBL28662642 0.89 MAPT (0.33) KDM4EMAPTNR2F2HTTSMN1; SMN2
SCHEMBL2747608 0.89 CDK8 (0.32) KDM4EMAPTL3MBTL1HTT
SCHEMBL10035248 0.88 MMP1 (0.31) SMN1; SMN2
SCHEMBL10035232 0.87 L3MBTL1 (0.32) KDM4EL3MBTL1SMN1; SMN2
SCHEMBL28653745 0.85 MAPT (0.34) KDM4EMAPTL3MBTL1NR2F2HTT
SCHEMBL9076962 0.84
SCHEMBL29002977 0.84 ABCB1 (0.32)
SCHEMBL10035236 0.84 L3MBTL1 (0.31) L3MBTL1
SCHEMBL677603 0.83 SPR (0.38) KDM4EMAPTNR2F2HTTSMN1; SMN2
SCHEMBL27934056 0.83 AR (0.36) MAPTL3MBTL1NR2F2HTTSMN1; SMN2

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-8178695-B2 Applying to unwanted plants or weeds; controlling broadleaf plants BAYER CROPSCIENCE AG (DE) 2012-05-15 US disclosed
US-20080254990-A1 4-(3-Aminobenzoyl)-1,3-dimethylpyrazoles and their use as herbicides BAYER CROPSCIENCE AG (DE) 2008-10-16 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-20080254990-A1 4-(3-Aminobenzoyl)-1,3-dimethylpyrazoles and their use as herbicides DDT, TH, ABAT KDM4E 645/4885MAPT 4271/4885L3MBTL1 455/4885

“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.