SCHEMBL2242769

SCHEMBL2242769

CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc(F)cc3)c(F)c2)ccn1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 3/20 0.79
BRAF P15056 11/20 0.78
MAPK14 Q16539 8/20 0.78
RIPK1 Q13546 2/20 0.78
PLK4 O00444 1/20 0.78
ACOX3 O15254 1/20 0.78
MAP3K7 O43318 1/20 0.78
DYRK3 O43781 1/20 0.78
JAK2 O60674 1/20 0.78
ERN1 O75460 1/20 0.78
RPS6KA4 O75676 1/20 0.78
STK10 O94804 1/20 0.78
MAP4K4 O95819 1/20 0.78
RAF1 P04049 1/20 0.78
NTRK1 P04629 1/20 0.78
LCK P06239 1/20 0.78
FYN P06241 1/20 0.78
CDK1 P06493 1/20 0.78
FES P07332 1/20 0.78
CSF1R P07333 1/20 0.78

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
SCHEMBL2241121 0.95 BRAF (0.79) ABL1BRAFMAPK14RIPK1PLK4
SCHEMBL2243259 0.94 ABL1 (0.78) ABL1BRAFMAPK14RIPK1PLK4
SCHEMBL2246323 0.94 ABL1 (0.77) ABL1BRAFMAPK14RIPK1PLK4
SCHEMBL2242801 0.94 ABL1 (0.79) ABL1BRAFMAPK14RIPK1PLK4
SCHEMBL2242285 0.94 ABL1 (0.79) ABL1BRAFMAPK14RIPK1PLK4
SCHEMBL2241374 0.94 BRAF (0.69) ABL1BRAFMAPK14RIPK1PLK4
SCHEMBL31265677 0.94 ABL1 (0.79) ABL1BRAFMAPK14RIPK1PLK4
SCHEMBL2241243 0.93 ABL1 (0.75) ABL1BRAFMAPK14RIPK1PLK4
SCHEMBL2243266 0.93 BRAF (0.80) ABL1BRAFMAPK14RIPK1PLK4
SCHEMBL2243163 0.93 BRAF (0.73) ABL1BRAFMAPK14RIPK1PLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110195110-A1 UREA COMPOUNDS USEFUL IN THE TREATMENT OF CANCER BAYER HEALTHCARE LLC 2011-08-11 US claimed
EP-2044053-A2 UREA COMPOUNDS USEFUL IN THE TREATMENT OF CANCER Bayer Healthcare, LLC (US) 2009-04-08 EP claimed
WO-2007064872-A2 UREA COMPOUNDS USEFUL IN THE TREATMENT OF CANCER BAYER HEALTHCARE LLC (US) 2007-06-07 WO claimed
US-20110195110-A1 UREA COMPOUNDS USEFUL IN THE TREATMENT OF CANCER BAYER HEALTHCARE LLC 2011-08-11 US disclosed
US-20110195110-A1 UREA COMPOUNDS USEFUL IN THE TREATMENT OF CANCER BAYER HEALTHCARE LLC 2011-08-11 US disclosed
US-20110195110-A1 UREA COMPOUNDS USEFUL IN THE TREATMENT OF CANCER BAYER HEALTHCARE LLC 2011-08-11 US disclosed
EP-2044053-A2 UREA COMPOUNDS USEFUL IN THE TREATMENT OF CANCER Bayer Healthcare, LLC (US) 2009-04-08 EP disclosed
WO-2007064872-A2 UREA COMPOUNDS USEFUL IN THE TREATMENT OF CANCER BAYER HEALTHCARE LLC (US) 2007-06-07 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-20110195110-A1 UREA COMPOUNDS USEFUL IN THE TREATMENT OF CANCER UMPS, SLC14A1, CPS1 ABL1 3359/4885BRAF 338/4885MAPK14 3645/4885

“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.