SCHEMBL17662097

SCHEMBL17662097

FCc1cccc(Nc2nnc(-c3cccc(Oc4ccnc5cc(OC(F)(F)F)ccc45)c3)[nH]2)c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 9/20 0.40
▸ SYK P43405 1/20 0.36
▸ KDR P35968 8/20 0.35
▸ MET P08581 4/20 0.34
▸ NPY5R Q15761 1/20 0.34
▸ AXL P30530 2/20 0.34
▸ FLT4 P35916 1/20 0.34
▸ TEK Q02763 1/20 0.34
▸ TYRO3 Q06418 1/20 0.34
▸ MERTK Q12866 1/20 0.34
▸ MAPK14 Q16539 1/20 0.33
▸ TNNI3K Q59H18 1/20 0.33

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
SCHEMBL17339773 0.94 BRAF (0.41) BRAFKDRMETAXLFLT4
SCHEMBL12336459 0.89 BRAF (0.45) BRAFKDRAXLMAPK14TNNI3K
SCHEMBL12336447 0.82 BRAF (0.44) BRAFSYKKDRMETAXL
SCHEMBL12336399 0.82 BRAF (0.48) BRAFKDRMAPK14TNNI3K
SCHEMBL12336578 0.81 BRAF (0.46) BRAFKDRMAPK14TNNI3K
SCHEMBL12336249 0.81 GSK3A (0.49) BRAFSYKKDRMETAXL
SCHEMBL14949385 0.79 SYK (0.41) SYKKDRMETAXLFLT4
SCHEMBL12336445 0.79 BRAF (0.46) BRAFKDRAXLMAPK14TNNI3K
SCHEMBL14949313 0.78 KDR (0.46) KDRMETTEK
SCHEMBL12336457 0.78 BRAF (0.43) BRAFKDRMAPK14TNNI3K

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-20160096824-A1 Heterocyclic Compounds Useful for Kinase Inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. 2016-04-07 — — 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-20160096824-A1 Heterocyclic Compounds Useful for Kinase Inhibition MAP4K2, MAP3K20, MAP3K19 BRAF 39/4885SYK 637/4885KDR 533/4885

“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.

Send feedback