SCHEMBL17352152

SCHEMBL17352152

O=C(O)/C(=C(/C(=O)O)c1ccc(Cl)c(C(F)(F)F)c1)c1ccc(Cl)c(C(F)(F)F)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.51
NPFFR2 Q9Y5X5 1/20 0.49
PDK1 Q15118 1/20 0.46
SLC6A3 Q01959 1/20 0.45
PGR P06401 1/20 0.45
HSD11B1 P28845 1/20 0.45
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
HTR3E A5X5Y0 1/20 0.44
HTR3B O95264 1/20 0.44
HTR3A P46098 1/20 0.44
HTR3D Q70Z44 1/20 0.44
HTR3C Q8WXA8 1/20 0.44
NOTUM Q6P988 5/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
TMPRSS4 Q9NRS4 1/20 0.43

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
SCHEMBL17352154 1.00 KDR (0.51) KDRNPFFR2PDK1SLC6A3PGR
SCHEMBL375961 0.85 TSHR (0.59) KDRNPFFR2PDK1SLC6A3PGR
Hydrochloric Acid SCHEMBL6369011 0.84 TSHR (0.57) KDRNPFFR2PDK1SLC6A3PGR
SCHEMBL10656533 0.83 KDR (0.56) KDRNPFFR2PDK1SLC6A3PGR
SCHEMBL31059293 0.83 KDR (0.49) KDRNPFFR2PDK1SLC6A3PGR
SCHEMBL31542016 0.81 KDR (0.54) KDRNPFFR2PDK1SLC6A3PGR
SCHEMBL1794695 0.81 KDR (0.54) KDRNPFFR2PDK1SLC6A3PGR
SCHEMBL27360051 0.81 NPFFR2 (0.46) KDRNPFFR2PDK1SLC6A3PGR
SCHEMBL1086197 0.80 NPFFR2 (0.58) KDRNPFFR2PDK1SLC6A3HSD11B1
SCHEMBL31144967 0.80 NPFFR2 (0.58) KDRNPFFR2PDK1SLC6A3HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150372349-A1 NON-AQUEOUS ELECTROLYTE AND ELECTRICITY STORAGE DEVICE UBE INDUSTRIES, LTD. (JP) 2015-12-24 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-20150372349-A1 NON-AQUEOUS ELECTROLYTE AND ELECTRICITY STORAGE DEVICE HCN2, SCO2, HCN1 KDR 3154/4885NPFFR2 785/4885PDK1 383/4885

“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.