SCHEMBL4134941

SCHEMBL4134941

COc1cc(CNC(=O)CN2C(=O)C(C)(C)c3cc4nc(-c5cc(C)[nH]n5)[nH]c4cc32)cc(OC)c1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AURKA O14965 3/20 0.58
AURKB Q96GD4 2/20 0.58
FGFR1 P11362 15/20 0.39
FGFR2 P21802 15/20 0.39
FGFR3 P22607 15/20 0.39
KDR P35968 13/20 0.39
ITGB3 P05106 1/20 0.37
ITGAV P06756 1/20 0.37
JAK2 O60674 1/20 0.36
PDGFRB P09619 1/20 0.36
FGFR4 P22455 1/20 0.36
FLT3 P36888 1/20 0.36
RXFP1 Q9HBX9 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL4138011 0.88 AURKA (0.61) AURKAAURKBITGB3ITGAVKMT2A
SCHEMBL4143313 0.86 AURKA (0.59) AURKAAURKBITGB3ITGAV
SCHEMBL4893591 0.85 AURKA (0.40) AURKAAURKBFGFR1FGFR3KDR
SCHEMBL4130252 0.81 AURKA (0.69) AURKAAURKBKDRFLT3
SCHEMBL4130802 0.80 AURKA (0.61) AURKAAURKBKMT2A
SCHEMBL4945475 0.78 AURKA (0.92) AURKAAURKBFGFR1FGFR2FGFR3
SCHEMBL4143677 0.78 AURKA (0.73) AURKAAURKBFGFR1FGFR2FGFR3
SCHEMBL4133178 0.77 AURKA (0.73) AURKAAURKBFGFR1FGFR2FGFR3
SCHEMBL4138252 0.76 AURKA (0.73) AURKAAURKBFGFR1FGFR2FGFR3
SCHEMBL4140608 0.76 AURKA (0.61) AURKAAURKBFGFR1FGFR2FGFR3

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
US-20090143375-A1 Tricyclic Lactam Derivatives, Their Manufacture and Use as Pharmaceutical Agents F. HOFFMANN-LA ROCHE AG (CH) 2009-06-04 US claimed
US-20090143375-A1 Tricyclic Lactam Derivatives, Their Manufacture and Use as Pharmaceutical Agents F. HOFFMANN-LA ROCHE AG (CH) 2009-06-04 US disclosed
EP-1966213-A1 TRICYCLIC LACTAM DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F.HOFFMANN-LA ROCHE AG (CH) 2008-09-10 EP disclosed
WO-2007068465-A1 TRICYCLIC LACTAM DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2007-06-21 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-20090143375-A1 Tricyclic Lactam Derivatives, Their Manufacture and Use as Pharmaceutical Agents AAAS, CYP3A5, BRCA1 AURKA 2294/4885AURKB 2649/4885FGFR1 4281/4885

“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.