SCHEMBL5899283

SCHEMBL5899283

Cc1cc(ON2C=Cc3sncc3C2)ccc1NC(=O)Nc1cc(C(F)(F)F)ccc1F

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BRAF P15056 14/20 0.44
KDR P35968 11/20 0.44
TEK Q02763 2/20 0.40
NTRK1 P04629 2/20 0.39
RET P07949 2/20 0.39
PDGFRB P09619 2/20 0.39
CDK8 P49336 2/20 0.39
NTRK3 Q16288 2/20 0.39
MAPK14 Q16539 2/20 0.39
NTRK2 Q16620 2/20 0.39
PDGFRA P16234 1/20 0.39
LTK P29376 1/20 0.39
FLT3 P36888 1/20 0.39
AURKB Q96GD4 1/20 0.39
RAB9A P51151 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
SCHEMBL5899326 0.89 CA12 (0.46) BRAFKDRTEKPDGFRB
SCHEMBL5899284 0.85 KDR (0.44) BRAFKDRTEKNTRK1RET
SCHEMBL5899288 0.83 KDR (0.47) BRAFKDRTEKNTRK1RET
SCHEMBL5899310 0.83 KDR (0.51) BRAFKDRTEKRETPDGFRB
SCHEMBL5899271 0.71 CDK8 (0.49) BRAFKDRPDGFRBCDK8MAPK14
SCHEMBL5899285 0.70 KDR (0.54) BRAFKDRTEK
SCHEMBL5899280 0.66 KDR (0.44) BRAFKDRTEK
SCHEMBL15925265 0.64 CA12 (0.55) BRAFKDRNTRK1RETPDGFRB
SCHEMBL59556 0.62 CA12 (0.56) BRAFKDRNTRK1RETPDGFRB
SCHEMBL3844571 0.62 KDR (0.47) BRAFKDRTEKNTRK1RET

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 BRAF 34/4885KDR 45/4885TEK 203/4885

“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.