SCHEMBL13041468

SCHEMBL13041468

Cc1cc(Cl)ccc1-c1nc(C2C(=O)C(C)(C)C(=O)C(C)(C)C2=O)c(C)s1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 2/20 0.34
▸ CASP3 P42574 1/20 0.33
▸ SHMT1 P34896 1/20 0.33
▸ SHMT2 P34897 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ GRM2 Q14416 1/20 0.33
▸ TP53 P04637 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ MAPT P10636 1/20 0.32
▸ NPBWR1 P48145 1/20 0.32
▸ ABL1 P00519 1/20 0.31
▸ BRD4 O60885 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ PTGDR2 Q9Y5Y4 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
SCHEMBL13041471 0.91 SHMT1 (0.42) SHMT1SHMT2LMNAKDM4EMAPT
SCHEMBL13041383 0.88 APEX1 (0.35) SHMT1SHMT2LMNAGRM2TP53
SCHEMBL13041360 0.83 RAB9A (0.41) NOTUMCASP3KDM4EMAPTMEN1
SCHEMBL13041464 0.81 ALDH1A1 (0.38) CASP3LMNATP53KDM4EMAPT
SCHEMBL13077936 0.79 GRM2 (0.35) NOTUMCASP3SHMT1SHMT2LMNA
SCHEMBL13041466 0.79 ABL1 (0.33) KDM4EMAPTNPBWR1ABL1BRD4
SCHEMBL10237929 0.78 ACHE (0.39) NOTUMCASP3SHMT1SHMT2LMNA
SCHEMBL13041470 0.77 KDM4E (0.39) KDM4EMAPTALDH1A1
SCHEMBL13041420 0.76 GRM2 (0.36) SHMT1SHMT2LMNAGRM2
SCHEMBL13041511 0.74 GLA (0.36) NOTUMCASP3SHMT1SHMT2GRM2

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-8956999-B2 Herbicides SYNGENTA LIMITED (GB) 2015-02-17 — — US disclosed
EP-2173727-B1 NOVEL HERBICIDES SYNGENTA LTD (GB) 2013-11-06 — — EP disclosed
US-20100279868-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-11-04 — — US disclosed
WO-2009000533-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2008-12-31 — — 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-20100279868-A1 NOVEL HERBICIDES DDT, HPD, HSD17B1 NOTUM 216/4885CASP3 727/4885SHMT1 376/4885

“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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