SCHEMBL545361

SCHEMBL545361

CC(=O)Nc1cc(Oc2ccc3c(c2)CC(C(=O)Nc2cc(C(C)(C)C)no2)CC3)ccn1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 6/20 0.59
MAPK13 O15264 3/20 0.59
RAF1 P04049 13/20 0.59
BRAF P15056 13/20 0.59
KDR P35968 1/20 0.42

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
SCHEMBL546086 0.84 BRAF (0.65) RAF1BRAFKDR
SCHEMBL545693 0.81 BRAF (0.68) RAF1BRAFKDR
SCHEMBL545703 0.81 BRAF (0.68) RAF1BRAFKDR
SCHEMBL545802 0.80 BRAF (0.62) MAPK14RAF1BRAFKDR
SCHEMBL546566 0.80 BRAF (0.64) RAF1BRAFKDR
SCHEMBL545232 0.79 BRAF (0.66) RAF1BRAFKDR
SCHEMBL546182 0.79 BRAF (0.77) RAF1BRAFKDR
SCHEMBL461378 0.78 BRAF (0.64) RAF1BRAFKDR
SCHEMBL345458 0.78 BRAF (0.64) RAF1BRAFKDR
SCHEMBL546516 0.78 BRAF (0.62) RAF1BRAFKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8110687-B2 Bicyclic compounds with kinase inhibitory activity MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-02-07 US disclosed
US-20070149533-A1 Bicyclic compounds with kinase inhibitory activity MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-06-28 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-20070149533-A1 Bicyclic compounds with kinase inhibitory activity MAP3K20, MAP3K1, MAP3K5 MAPK14 278/4885MAPK13 276/4885RAF1 198/4885

“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.