SCHEMBL3462249

SCHEMBL3462249

CNC(=O)c1cc(-c2cccc(CN[C@H]3CCc4ccccc43)c2)cnc1N

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MERTK Q12866 13/20 0.46
AXL P30530 12/20 0.46
CFD P00746 3/20 0.45
PIK3C3 Q8NEB9 1/20 0.43
KDM4E B2RXH2 1/20 0.42
MET P08581 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
SCHEMBL3462368 0.90 MERTK (0.43) MERTKAXLPIK3C3MET
SCHEMBL3460453 0.89 MET (0.45) MERTKAXLPIK3C3MET
SCHEMBL3461403 0.87 MERTK (0.43) MERTKAXLPIK3C3MET
SCHEMBL3461708 0.84 PIK3CD (0.51)
SCHEMBL3461941 0.84 PIK3CD (0.51)
SCHEMBL13401171 0.84 PIK3CD (0.51)
SCHEMBL3462510 0.84 MERTK (0.43) MERTKAXLPIK3C3MET
SCHEMBL3461547 0.84 AXL (0.42) MERTKAXLPIK3C3MET
SCHEMBL3460036 0.81 PDE4A (0.37) MERTKAXLCFDKDM4E
SCHEMBL3461360 0.79 ATR (0.46)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1501514-B1 PROTEIN KINASE MODULATORS AND METHODS OF USE EXELIXIS INC (US) 2012-12-19 EP claimed
US-20060211709-A1 Protein kinase modulators and methods of use EXELIXIS, INC. 2006-09-21 US claimed
EP-1501514-B1 PROTEIN KINASE MODULATORS AND METHODS OF USE EXELIXIS INC (US) 2012-12-19 EP disclosed
US-7704995-B2 Protein kinase modulators and methods of use EXELIXIS, INC. (US) 2010-04-27 US disclosed
US-20060211709-A1 Protein kinase modulators and methods of use EXELIXIS, INC. 2006-09-21 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-20060211709-A1 Protein kinase modulators and methods of use GRK2, MAP4K2, MAPKAPK2 MERTK 833/4885AXL 895/4885CFD 4879/4885

“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.