SCHEMBL10187644

SCHEMBL10187644

CCc1cc(Oc2ccc3cc(Cl)ccc3n2)ccc1C1=C(O)[C@H]2[C@@H](C1=O)[C@@H]1CC[C@H]2O1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.33
SCN9A Q15858 3/20 0.32
SCN10A Q9Y5Y9 2/20 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
SCHEMBL10187595 0.85 ELANE (0.33) PDE4B
SCHEMBL10196187 0.82 PDE4B (0.32) PDE4BSCN9ASCN10A
SCHEMBL19070713 0.82 ALOX5 (0.33) PDE4B
SCHEMBL10196317 0.82 ALOX5 (0.33) PDE4B
SCHEMBL10196184 0.82 CYP1A2 (0.38)
SCHEMBL19071023 0.81 MEN1 (0.32) PDE4BSCN9ASCN10A
SCHEMBL10187650 0.78 PDE4B (0.34) PDE4BSCN9A
SCHEMBL19070661 0.78 MAOA (0.34) PDE4B
SCHEMBL10196000 0.78 MAOA (0.34) PDE4B
SCHEMBL10195455 0.77 PDE4B (0.32) PDE4BSCN9ASCN10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2393769-B1 NOVEL HERBICIDES SYNGENTA LTD (GB) 2014-12-10 EP disclosed
US-8680339-B2 Herbicides SYNGENTA LIMITED (GB) 2014-03-25 US disclosed
US-8680339-B2 Herbicides SYNGENTA LIMITED (GB) 2014-03-25 US disclosed
US-20120028800-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-02-02 US disclosed
US-20120028800-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-02-02 US disclosed
WO-2010089210-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2010-08-12 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-20120028800-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 PDE4B 1225/4885SCN9A 2224/4885SCN10A 1828/4885

“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.