SCHEMBL3276644

SCHEMBL3276644

O=C(Nc1cc(F)cc(C(F)(F)F)c1)Nc1ccc(Cl)c(C(F)(F)F)c1

nearest known ligand 0.74

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.74
TRPV1 Q8NER1 8/20 0.58
CA1 P00915 5/20 0.58
CA2 P00918 5/20 0.58
CA7 P43166 5/20 0.58
CA9 Q16790 5/20 0.58
PDK1 Q15118 1/20 0.56
HDAC1 Q13547 1/20 0.55
HDAC8 Q9BY41 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55
BRAF P15056 1/20 0.52
MTOR P42345 1/20 0.52
SLC6A3 Q01959 1/20 0.52

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
SCHEMBL11002386 0.92 KDR (0.82) KDRTRPV1CA1CA2CA7
SCHEMBL5867039 0.90 KDR (0.74) KDRTRPV1CA1CA2CA7
SCHEMBL3811573 0.88 KDR (0.76) KDRTRPV1CA1CA2CA7
SCHEMBL3275816 0.87 LMNA (0.59) KDRTRPV1PDK1BRAF
SCHEMBL3815898 0.87 KDR (0.74) KDRTRPV1CA1CA2CA7
SCHEMBL29364392 0.86 KDR (1.00) KDRTRPV1CA1CA2CA7
SCHEMBL118026 0.86 KDR (1.00) KDRTRPV1CA1CA2CA7
SCHEMBL16884950 0.85 KDR (0.85) KDRTRPV1CA1CA2CA7
SCHEMBL11005015 0.85 KDR (0.85) KDRTRPV1CA1CA2CA7
SCHEMBL3275762 0.84 MAPT (0.60) KDRCA1CA2CA9MTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7696249-B2 Diphenyl urea derivatives ARPIDA AG (CH) 2010-04-13 US claimed
US-20090005452-A1 Diphenyl Urea Derivatives ARIPIDA AG (CH) 2009-01-01 US claimed
CN-101326157-A Diphenyl urea derivatives ARPIDA AG (CH) 2008-12-17 CN claimed
EP-1973871-A1 DIPHENYL UREA DERIVATIVES Arpida AG (CH) 2008-10-01 EP claimed
WO-2007068395-A1 DIPHENYL UREA DERIVATIVES ARPIDA AG (CH) 2007-06-21 WO claimed
US-7696249-B2 Diphenyl urea derivatives ARPIDA AG (CH) 2010-04-13 US disclosed
US-7696249-B2 Diphenyl urea derivatives ARPIDA AG (CH) 2010-04-13 US disclosed
US-7696249-B2 Diphenyl urea derivatives ARPIDA AG (CH) 2010-04-13 US disclosed
US-20090005452-A1 Diphenyl Urea Derivatives ARIPIDA AG (CH) 2009-01-01 US disclosed
US-20090005452-A1 Diphenyl Urea Derivatives ARIPIDA AG (CH) 2009-01-01 US disclosed
US-20090005452-A1 Diphenyl Urea Derivatives ARIPIDA AG (CH) 2009-01-01 US disclosed
CN-101326157-A Diphenyl urea derivatives ARPIDA AG (CH) 2008-12-17 CN disclosed
EP-1973871-A1 DIPHENYL UREA DERIVATIVES Arpida AG (CH) 2008-10-01 EP disclosed
WO-2007068395-A1 DIPHENYL UREA DERIVATIVES ARPIDA AG (CH) 2007-06-21 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-20090005452-A1 Diphenyl Urea Derivatives UROD, UGP2, UMPS KDR 4676/4885TRPV1 3091/4885CA1 4813/4885

“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.