SCHEMBL13622708

SCHEMBL13622708

COc1cc2nc(N3CCOCC3)nc(N/C(=N/N=O)Nc3cccc(C)c3)c2cc1OCCN1CCOCC1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EGFR P00533 8/20 0.56
KDR P35968 5/20 0.56
BRAF P15056 4/20 0.56
FLT3 P36888 1/20 0.50
SRC P12931 1/20 0.48
ROCK2 O75116 2/20 0.48
EHMT2 Q96KQ7 2/20 0.47
EHMT1 Q9H9B1 1/20 0.47
MAPK14 Q16539 1/20 0.47
AURKA O14965 2/20 0.45
AURKB Q96GD4 1/20 0.45
RAF1 P04049 2/20 0.45

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
SCHEMBL425677 0.93 EGFR (0.56) EGFRKDRBRAFFLT3SRC
SCHEMBL10160948 0.93 EGFR (0.56) EGFRKDRBRAFFLT3SRC
SCHEMBL10160951 0.90 EGFR (0.54) EGFRKDRBRAFFLT3SRC
SCHEMBL426640 0.90 EGFR (0.54) EGFRKDRBRAFFLT3SRC
SCHEMBL428513 0.90 EGFR (0.53) EGFRKDRBRAFFLT3SRC
SCHEMBL10160950 0.90 EGFR (0.53) EGFRKDRBRAFFLT3SRC
SCHEMBL4121881 0.90 BRAF (0.67) EGFRKDRBRAFFLT3ROCK2
SCHEMBL458720 0.88 EGFR (0.57) EGFRKDRBRAFFLT3SRC
SCHEMBL426005 0.88 EGFR (0.57) EGFRKDRBRAFFLT3SRC
SCHEMBL425675 0.85 EGFR (0.48) EGFRKDRBRAFSRCEHMT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8318730-B2 Fused hetrocyclic compounds SYNTA PHARMACEUTICALS CORPORATION (US) 2012-11-27 US disclosed
US-7615552-B2 Fused heterocyclic compounds SYNTA PHARMACEUTICALS CORP. (US) 2009-11-10 US disclosed
US-20090253694-A1 Fused hetrocyclic compounds SYNTA PHARMACEUTICALS CORP. (US) 2009-10-08 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-20090253694-A1 Fused hetrocyclic compounds IL2, IL15, IL4 EGFR 3409/4885KDR 3480/4885BRAF 4124/4885

“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.