SCHEMBL13041543

SCHEMBL13041543

CCc1sc(-c2ccccc2)nc1C1C(=O)C(C)(C)OC(C)(C)C1=O

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ PTGDR2 Q9Y5Y4 3/20 0.40
▸ GLA P06280 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.38
▸ ALOX5 P09917 2/20 0.38
▸ TRPM8 Q7Z2W7 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ KMT2A Q03164 1/20 0.36

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
SCHEMBL13041546 0.88 DCK (0.42) PTGDR2MAPTTRPM8KMT2A
SCHEMBL13986201 0.88 L3MBTL1 (0.33) L3MBTL1PTGDR2GLAHRH3
SCHEMBL2762937 0.88 HRH3 (0.41) PTGDR2ALDH1A1MAPTHRH3ALOX5
SCHEMBL13041483 0.88 PTGDR2 (0.37) L3MBTL1PTGDR2GLAALDH1A1MAPT
SCHEMBL13041530 0.86 DCK (0.32) L3MBTL1PTGDR2GLAKMT2A
SCHEMBL13041549 0.85 NPC1 (0.41) ALDH1A1MAPTKDM4ENPC1RAB9A
SCHEMBL13077790 0.85 L3MBTL1 (0.43) L3MBTL1PTGDR2GLAALDH1A1MAPT
SCHEMBL13041552 0.84 CDC7 (0.37) L3MBTL1
SCHEMBL13041513 0.82 RAB9A (0.36) L3MBTL1PTGDR2ALDH1A1MAPTNPC1
SCHEMBL13041547 0.82 PTGDR2 (0.44) PTGDR2GLAALDH1A1TRPM8KDM4E

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
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 L3MBTL1 3731/4885PTGDR2 865/4885GLA 3973/4885

“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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