SCHEMBL5055076

SCHEMBL5055076

CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(-c4cn[nH]c4)c3)cc2F)n(-c2ccc3c(c2)CCNC3)n1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.61
MAPK14 Q16539 7/20 0.42
BRAF P15056 10/20 0.41
FLT1 P17948 3/20 0.40
KDR P35968 3/20 0.40
AXL P30530 2/20 0.40
PLK4 O00444 1/20 0.40
ACOX3 O15254 1/20 0.40
MAP3K7 O43318 1/20 0.40
DYRK3 O43781 1/20 0.40
JAK2 O60674 1/20 0.40
ERN1 O75460 1/20 0.40
RPS6KA4 O75676 1/20 0.40
STK10 O94804 1/20 0.40
MAP4K4 O95819 1/20 0.40
RAF1 P04049 1/20 0.40
NTRK1 P04629 1/20 0.40
LCK P06239 1/20 0.40
FYN P06241 1/20 0.40
CDK1 P06493 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
SCHEMBL5056456 0.91 ABL1 (0.50) ABL1MAPK14BRAFKDRAXL
SCHEMBL30681063 0.91 ABL1 (0.75) ABL1MAPK14BRAFFLT1KDR
SCHEMBL2030799 0.91 ABL1 (0.75) ABL1MAPK14BRAFFLT1KDR
SCHEMBL5054907 0.90 ABL1 (0.61) ABL1MAPK14BRAFFLT1KDR
SCHEMBL5055222 0.89 ABL1 (0.48) ABL1MAPK14BRAFFLT1KDR
SCHEMBL3076188 0.88 ABL1 (0.71) ABL1MAPK14BRAFFLT1KDR
SCHEMBL30681081 0.88 ABL1 (0.71) ABL1MAPK14BRAFFLT1KDR
SCHEMBL5052366 0.88 ABL1 (0.47) ABL1MAPK14BRAFFLT1KDR
Hydrochloric Acid SCHEMBL2030220 0.88 ABL1 (0.70) ABL1MAPK14BRAFFLT1KDR
SCHEMBL5055296 0.86 ABL1 (0.65) ABL1MAPK14BRAFFLT1KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080113967-A1 ENZYME MODULATORS AND TREATMENTS DECIPHERA PHARMACEUTICALS, LLC (US) 2008-05-15 US claimed

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-20080113967-A1 ENZYME MODULATORS AND TREATMENTS ABL2, BRAF, MAP3K1 ABL1 20/4885MAPK14 100/4885BRAF 2/4885

“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.