SCHEMBL5485300

SCHEMBL5485300

C[Si](C)(C)CCOCn1c(C(=O)NCCN2CCOCC2)cc2c(Oc3ccc(N)cc3F)ncnc21.Nc1ccc(F)cc1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MET P08581 6/20 0.45
KDR P35968 5/20 0.45
CD274 Q9NZQ7 3/20 0.42
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
AXL P30530 1/20 0.39
JAK2 O60674 2/20 0.39
CNR2 P34972 2/20 0.39
CNR1 P21554 1/20 0.38
HTR3A P46098 1/20 0.38

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
SCHEMBL4417460 0.97 CD274 (0.44) METKDRCD274HPGDAXL
SCHEMBL4417454 0.89 CD274 (0.46) METKDRCD274JAK2
SCHEMBL12424217 0.86 MET (0.62) METKDRAXLJAK2
SCHEMBL12424215 0.78 NPC1 (0.34) METAXL
SCHEMBL3566461 0.72 KDR (0.49) METKDRCD274HPGDAXL
SCHEMBL2198176 0.71 MET (0.56) METKDRAXL
SCHEMBL12509800 0.70 TRPA1 (0.32) AXL
SCHEMBL4811241 0.70 MET (0.66) METKDR
SCHEMBL2197589 0.69 MET (0.53) METKDR
SCHEMBL5570163 0.69 AXL (0.73) METKDRAXLJAK2

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-20070179130-A1 c-MET MODULATORS AND METHOD OF USE EXELIXIS, INC. 2007-08-02 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-20070179130-A1 c-MET MODULATORS AND METHOD OF USE FLT4, MET, KDR MET 2/4885KDR 3/4885CD274 693/4885

“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.