SCHEMBL3211787

SCHEMBL3211787

Cc1ccc(NC(=O)Nc2cn(C(C)(C)C)nc2C(=O)N2CCNC(=O)C2(C)C)cc1-c1ccc(CN2CCOCC2)cn1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AURKA O14965 3/20 0.35
AURKB Q96GD4 3/20 0.35
ABL1 P00519 3/20 0.34
BCR P11274 3/20 0.34
RAF1 P04049 11/20 0.34
BRAF P15056 11/20 0.34
HIF1A Q16665 1/20 0.34
EPAS1 Q99814 1/20 0.34
CNR2 P34972 1/20 0.33

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
SCHEMBL3206400 0.89 RAF1 (0.35) AURKAAURKBABL1BCRRAF1
SCHEMBL3221151 0.88 RAF1 (0.41) AURKAAURKBABL1RAF1BRAF
SCHEMBL13495534 0.86 CHEK1 (0.35) AURKAAURKBABL1BCRRAF1
SCHEMBL3215115 0.85 BRAF (0.41) RAF1BRAF
SCHEMBL196232 0.82 MAPK14 (0.43)
SCHEMBL3219188 0.80 RAF1 (0.34) AURKAAURKBABL1RAF1BRAF
SCHEMBL3221271 0.80 KIF18A (0.40) ABL1BCRBRAF
SCHEMBL243872 0.79 RAF1 (0.34) AURKAAURKBABL1RAF1BRAF
SCHEMBL3208269 0.79 RAF1 (0.37) RAF1BRAF
SCHEMBL3212550 0.78 CYP3A4 (0.34) RAF1BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010019930-A1 UREA DERIVATIVES AS INHIBITORS OF MAP KINASES LOCUS PHARMACEUTICALS, INC. (US) 2010-02-18 WO disclosed
US-20100041642-A1 UREA INHIBITORS OF MAP KINASES LOCUS PHARMACEUTICALS, INC. (US) 2010-02-18 US disclosed
US-20100041642-A1 UREA INHIBITORS OF MAP KINASES LOCUS PHARMACEUTICALS, INC. (US) 2010-02-18 US disclosed
US-20100041642-A1 UREA INHIBITORS OF MAP KINASES LOCUS PHARMACEUTICALS, INC. (US) 2010-02-18 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-20100041642-A1 UREA INHIBITORS OF MAP KINASES MAP4K2, MAP3K1, MAP3K20 AURKA 495/4885AURKB 328/4885ABL1 868/4885

“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.