SCHEMBL2759780

SCHEMBL2759780

CCOC(=O)OC1=C(c2cc(Br)c(C)cc2C)C(=O)NC12CCN(OC)CC2

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.33
TSHR P16473 2/20 0.33
ACACB O00763 3/20 0.32
ACACA Q13085 3/20 0.32
ALDH1A1 P00352 2/20 0.31
FPR2 P25090 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
KDM4E B2RXH2 1/20 0.30
BCHE P06276 1/20 0.30
CES1 P23141 1/20 0.30
CUL4A Q13619 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
SCHEMBL2759758 0.88 ACACB (0.36) TSHRACACBACACAALDH1A1FPR2
SCHEMBL2759796 0.88 TDP2 (0.37) TSHRACACBACACAALDH1A1FPR2
SCHEMBL2759784 0.87 ACACB (0.33) ACACBACACA
SCHEMBL2759781 0.86 ACACB (0.30) ACACBACACABCHECES1
SCHEMBL251850 0.86 ACACB (0.38) SMN1; SMN2TSHRACACBACACAALDH1A1
SCHEMBL29836257 0.86 ACACB (0.38) SMN1; SMN2TSHRACACBACACAALDH1A1
SCHEMBL2759782 0.84 ACACB (0.43) SMN1; SMN2ACACBACACAALDH1A1KDM4E
SCHEMBL2759778 0.84 FPR2 (0.33) FPR2
SCHEMBL15182363 0.83 ACACB (0.36) SMN1; SMN2TSHRACACBACACAALDH1A1
SCHEMBL15182362 0.82 KDM4E (0.36) SMN1; SMN2ACACBACACAALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2352375-B1 HERBICIDAL COMPOSITIONS SYNGENTA PARTICIPATIONS AG (CH) 2015-03-25 EP disclosed
US-8722578-B2 Spiroheterocyclic pyrrolidinedione herbicidal compositions SYNGENTA PARTICIPATIONS AG (CH) 2014-05-13 US disclosed
US-8722578-B2 Spiroheterocyclic pyrrolidinedione herbicidal compositions SYNGENTA PARTICIPATIONS AG (CH) 2014-05-13 US disclosed
US-20120004105-A1 HERBICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION LLC (US) 2012-01-05 US disclosed
US-20120004105-A1 HERBICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION LLC (US) 2012-01-05 US disclosed
WO-2010052161-A2 HERBICIDAL COMPOSITIONS SYNGENTA PARTICIPATIONS AG (CH) 2010-05-14 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-20120004105-A1 HERBICIDAL COMPOSITIONS DDT, CAT, HDHD5 SMN1; SMN2 3310/4885TSHR 2712/4885ACACB 704/4885

“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.