SCHEMBL973466

SCHEMBL973466

COCc1nc2nc(C(F)(F)F)ccc2cc1C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SYK P43405 8/20 0.37
KDM5A P29375 1/20 0.36
KDM5B Q9UGL1 1/20 0.36
PDE4B Q07343 2/20 0.35
HCAR2 Q8TDS4 1/20 0.35
TAS2R14 Q9NYV8 1/20 0.34
SCN9A Q15858 1/20 0.34
SCN10A Q9Y5Y9 1/20 0.34
MRGPRX4 Q96LA9 1/20 0.34

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
SCHEMBL124183 0.89 NPC1 (0.43) PDE4BSCN9ASCN10A
SCHEMBL126502 0.85 GABRP (0.43) SYKTAS2R14
SCHEMBL127078 0.78 ALDH1A1 (0.49) SYKTAS2R14
SCHEMBL122983 0.76 TAS2R14 (0.40) SYKTAS2R14
SCHEMBL125953 0.74 KDM4E (0.37) KDM5AKDM5BHCAR2MRGPRX4
SCHEMBL125294 0.74 HCAR2 (0.36) KDM5AKDM5BHCAR2
SCHEMBL6840685 0.74 HCAR2 (0.44) KDM5AKDM5BHCAR2
SCHEMBL125773 0.73 KDM4E (0.41) SYK
SCHEMBL1201731 0.73 NPC1 (0.40) SYKPDE4BTAS2R14
SCHEMBL29929108 0.73 NPC1 (0.40) SYKPDE4BTAS2R14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8461083-B2 Herbicidal compounds SYNGENTA LIMITED (GB) 2013-06-11 US disclosed
US-20110021352-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-01-27 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-20110021352-A1 HERBICIDAL COMPOUNDS RDX, NQO2, DDT SYK 3883/4885KDM5A 676/4885KDM5B 744/4885

“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.