SCHEMBL5899284

SCHEMBL5899284

Cc1cc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)ccc1ON1C=Cc2sncc2C1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 15/20 0.44
BRAF P15056 8/20 0.44
PDGFRB P09619 5/20 0.43
FLT3 P36888 2/20 0.43
NTRK1 P04629 1/20 0.43
RET P07949 1/20 0.43
LTK P29376 1/20 0.43
CDK8 P49336 1/20 0.43
NTRK3 Q16288 1/20 0.43
MAPK14 Q16539 1/20 0.43
NTRK2 Q16620 1/20 0.43
AURKB Q96GD4 1/20 0.43
IDH1 O75874 1/20 0.43
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
TEK Q02763 5/20 0.40
LCK P06239 1/20 0.40
CSF1R P07333 1/20 0.40

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
SCHEMBL5899288 0.93 KDR (0.47) KDRBRAFPDGFRBFLT3NTRK1
SCHEMBL5899326 0.88 CA12 (0.46) KDRBRAFPDGFRBCA12CA1
SCHEMBL5899283 0.85 BRAF (0.44) KDRBRAFPDGFRBFLT3NTRK1
SCHEMBL5899267 0.84 KDR (0.47) KDRBRAFCDK8CA9RAF1
SCHEMBL5899310 0.75 KDR (0.51) KDRBRAFPDGFRBFLT3RET
SCHEMBL5899271 0.72 CDK8 (0.49) KDRBRAFPDGFRBFLT3CDK8
SCHEMBL5899287 0.69 KDR (0.55) KDRBRAFTEKRAF1
SCHEMBL5899281 0.67 BRAF (0.44) KDRBRAFPDGFRBFLT3NTRK1
SCHEMBL13541769 0.67 CA12 (0.69) KDRPDGFRBFLT3NTRK1RET
SCHEMBL4243355 0.65 MEN1 (0.55) KDRBRAFIDH1RAF1

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 34/4885PDGFRB 1562/4885

“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.