SCHEMBL10195455

SCHEMBL10195455

CCc1ccc(Oc2ccc3cc(Cl)ccc3n2)cc1C1=C(O)C2CCC(C2)C1=O

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.32
SCN9A Q15858 5/20 0.31
SCN10A Q9Y5Y9 2/20 0.31
SCN7A Q01118 1/20 0.30
KCNH2 Q12809 1/20 0.30
SCN5A Q14524 1/20 0.30
SCN2A Q99250 1/20 0.30
SCN8A Q9UQD0 1/20 0.30
ATF4 P18848 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
SCHEMBL10254648 1.00 PDE4B (0.32) PDE4BSCN9ASCN10ASCN7AKCNH2
SCHEMBL10195450 0.88 CYP1A2 (0.39)
SCHEMBL10255136 0.88 CYP1A2 (0.39)
SCHEMBL10196187 0.86 PDE4B (0.32) PDE4BSCN9ASCN10ASCN7AKCNH2
SCHEMBL19071023 0.84 MEN1 (0.32) PDE4BSCN9ASCN10ASCN7AKCNH2
SCHEMBL10194959 0.84 FFAR4 (0.36) KCNH2
SCHEMBL10195581 0.82 PPARG (0.35) KCNH2
SCHEMBL10195194 0.81 HTR2A (0.39) KCNH2
SCHEMBL10195585 0.81 EPHX2 (0.33) KCNH2
SCHEMBL10196170 0.81 PDE4B (0.34) PDE4BSCN9ASCN7AKCNH2SCN5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140378305-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2014-12-25 US disclosed
US-8865623-B2 Herbicidally active cyclic diones and derivatives thereof, processes for their preparation, compositions, and method of controlling weeds SYNGENTA LIMITED (GB) 2014-10-21 US disclosed
US-20120021907-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 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 (2 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-20140378305-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 PDE4B 965/4885SCN9A 1880/4885SCN10A 2451/4885
US-20120021907-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.