SCHEMBL10238194

SCHEMBL10238194

Cc1sc(-c2ccc(Br)cn2)nc1C1=C(OC(=O)C2CC2)[C@@H]2CC[C@@H](C2)C1=O

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ ADAMTS5 Q9UNA0 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
SCHEMBL10238190 0.91 ADAMTS5 (0.31) ADAMTS5
SCHEMBL10238196 0.88 ADAMTS5 (0.30) ADAMTS5
SCHEMBL13058567 0.83 KDM4E (0.35) KDM4EALDH1A1MAPT
SCHEMBL13041563 0.78 KDM4E (0.36) KDM4EALDH1A1MAPTADAMTS5
SCHEMBL10238223 0.72 — —
SCHEMBL10237976 0.70 SPR (0.32) —
SCHEMBL10238250 0.68 RARA (0.35) —
SCHEMBL13041561 0.67 ADAMTS5 (0.32) ADAMTS5
SCHEMBL10238248 0.67 RARA (0.33) —
SCHEMBL10238182 0.67 SLC6A3 (0.37) KDM4E

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
EP-2176222-B1 NOVEL HERBICIDES SYNGENTA LTD (GB) 2014-11-05 — — EP disclosed
US-8541594-B2 — — 2013-09-24 — — US disclosed
US-8541594-B2 — — 2013-09-24 — — US disclosed
US-20120040826-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2012-02-16 — — US disclosed
US-20120040826-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2012-02-16 — — 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-20120040826-A1 NOVEL HERBICIDES DDT, HDHD5, DDC KDM4E 1609/4885ALDH1A1 294/4885MAPT 3907/4885

“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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