SCHEMBL2763388

SCHEMBL2763388

Cc1sc(-c2cc(Cl)ccc2Cl)nc1C1C(=O)C(C)(C)C(=O)C(C)(C)C1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AGPAT2 O15120 4/20 0.36
▸ HTR2B P41595 1/20 0.34
▸ PDE4D Q08499 1/20 0.34
▸ SHMT1 P34896 1/20 0.33
▸ SHMT2 P34897 1/20 0.33
▸ SIK1 P57059 1/20 0.33
▸ SIK2 Q9H0K1 1/20 0.33
▸ SIK3 Q9Y2K2 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ TP53 P04637 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ PDE2A O00408 1/20 0.32
▸ PDE10A Q9Y233 1/20 0.32
▸ SCN10A Q9Y5Y9 1/20 0.32
▸ DPP4 P27487 1/20 0.31
▸ DPP8 Q6V1X1 1/20 0.31
▸ PGR P06401 2/20 0.31
▸ PKM P14618 1/20 0.31
▸ RORC P51449 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
SCHEMBL13041471 0.91 SHMT1 (0.42) SHMT1SHMT2LMNAKDM4EMAPT
SCHEMBL13041468 0.88 NOTUM (0.34) SHMT1SHMT2LMNATP53KDM4E
SCHEMBL13041383 0.86 APEX1 (0.35) SHMT1SHMT2LMNATP53KDM4E
SCHEMBL13041464 0.85 ALDH1A1 (0.38) HTR2BLMNATP53KDM4EMAPT
SCHEMBL13041360 0.83 RAB9A (0.41) KDM4EMAPTALDH1A1
SCHEMBL13041470 0.82 KDM4E (0.39) KDM4EMAPTPGRPKMALDH1A1
SCHEMBL13041466 0.81 ABL1 (0.33) KDM4EMAPTALDH1A1
SCHEMBL10238062 0.78 ACHE (0.39) AGPAT2HTR2BPDE4DSHMT1SHMT2
SCHEMBL13041420 0.74 GRM2 (0.36) SHMT1SHMT2LMNA
SCHEMBL13041382 0.73 DCK (0.39) MAPTPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8956999-B2 Herbicides SYNGENTA LIMITED (GB) 2015-02-17 — — US disclosed
US-8956999-B2 Herbicides SYNGENTA LIMITED (GB) 2015-02-17 — — US disclosed
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
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
US-20100279868-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-11-04 — — US disclosed
US-20100279868-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-11-04 — — US disclosed
EP-2173727-A1 NOVEL HERBICIDES Syngenta Limited (GB) 2010-04-14 — — EP disclosed
WO-2009000533-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2008-12-31 — — WO 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 AGPAT2 572/4885HTR2B 1733/4885PDE4D 2394/4885

“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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