SCHEMBL5899288

SCHEMBL5899288

O=C(Nc1ccc(ON2C=Cc3sncc3C2)c(F)c1)Nc1cc(C(F)(F)F)ccc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 11/20 0.47
BRAF P15056 10/20 0.47
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
PDGFRB P09619 4/20 0.41
KIT P10721 1/20 0.40
FLT1 P17948 1/20 0.40
FLT4 P35916 1/20 0.40
TEK Q02763 1/20 0.40
RAF1 P04049 1/20 0.40
NTRK1 P04629 1/20 0.39
RET P07949 1/20 0.39
LTK P29376 1/20 0.39
FLT3 P36888 1/20 0.39
CDK8 P49336 1/20 0.39
NTRK3 Q16288 1/20 0.39
MAPK14 Q16539 1/20 0.39
NTRK2 Q16620 1/20 0.39

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
SCHEMBL5899284 0.93 KDR (0.44) KDRBRAFCA12CA1CA2
SCHEMBL5899326 0.90 CA12 (0.46) KDRBRAFCA12CA1CA2
SCHEMBL5899283 0.83 BRAF (0.44) KDRBRAFPDGFRBTEKNTRK1
SCHEMBL5899271 0.73 CDK8 (0.49) KDRBRAFCA1CA2CA9
SCHEMBL5899310 0.72 KDR (0.51) KDRBRAFPDGFRBKITFLT1
SCHEMBL21750965 0.68 CA12 (0.67) KDRBRAFCA12CA1CA2
SCHEMBL5899290 0.67 KDR (0.61) KDRBRAFTEKRAF1
SCHEMBL5899286 0.66 BRAF (0.48) KDRBRAFCA12CA1CA2
SCHEMBL21750852 0.66 CA12 (0.70) KDRCA12CA1CA2CA9
SCHEMBL4340395 0.65 CA12 (0.69) KDRCA12CA1CA2CA9

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-20060241301-A1 Urea derivatives and their use as tyrosinkinase inhibitors MERCK PATENT GMBH (DE) 2006-10-26 US claimed
US-20060241301-A1 Urea derivatives and their use as tyrosinkinase inhibitors MERCK PATENT GMBH (DE) 2006-10-26 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 (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-20060241301-A1 Urea derivatives and their use as tyrosinkinase inhibitors TIE1, UCK2, UTS2R KDR 45/4885BRAF 34/4885CA12 3994/4885

“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.