SCHEMBL13041572

SCHEMBL13041572

Cc1sc(-c2ccc(Cl)cc2F)nc1C1=C(OC(=O)C(C)(C)C)C(C)(C)C(=O)C(C)(C)C1=O

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ APEX1 P27695 1/20 0.34
▸ SHMT1 P34896 1/20 0.34
▸ SHMT2 P34897 1/20 0.34
▸ LMNA P02545 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ BCHE P06276 1/20 0.30
▸ CDC7 O00311 1/20 0.30
▸ DBF4 Q9UBU7 1/20 0.30
▸ PTGES O14684 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
SCHEMBL13041574 0.89 AGPAT2 (0.36) SHMT1SHMT2LMNAKDM4EMAPT
SCHEMBL13041557 0.74 PTGDR2 (0.40) KDM4EMAPT
SCHEMBL13041569 0.71 SHMT1 (0.33) SHMT1SHMT2CDC7DBF4
SCHEMBL13041383 0.68 APEX1 (0.35) APEX1SHMT1SHMT2LMNAKDM4E
SCHEMBL18004030 0.65 KDM4E (0.42) APEX1SHMT1SHMT2LMNAKDM4E
SCHEMBL13710178 0.64 HRH3 (0.41) KDM4E
SCHEMBL13761051 0.63 HRH3 (0.40) —
SCHEMBL13041564 0.62 L3MBTL1 (0.31) —
SCHEMBL12129371 0.62 ACACB (0.39) —
SCHEMBL18003426 0.62 HTR2B (0.51) APEX1SHMT1SHMT2LMNAKDM4E

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 5 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-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
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 APEX1 3523/4885SHMT1 376/4885SHMT2 383/4885

“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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