SCHEMBL2565971

SCHEMBL2565971

CCOC(=O)c1oc2c(C)cncc2c1Nc1ccc([Si](C)(C)C)cc1F

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 4/20 0.45
BRAF P15056 7/20 0.42
EIF2AK3 Q9NZJ5 6/20 0.42
THRB P10828 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MAP2K2 P36507 1/20 0.34
TP53 P04637 1/20 0.34
LMNA P02545 1/20 0.34
ALOX5 P09917 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
SCHEMBL2565520 0.93 MAP2K1 (0.52) MAP2K1BRAFEIF2AK3THRBKDM4E
SCHEMBL2569311 0.91 MAP2K1 (0.45) MAP2K1BRAFEIF2AK3THRBKDM4E
SCHEMBL2567376 0.91 MAP2K1 (0.44) MAP2K1BRAFEIF2AK3THRBKDM4E
SCHEMBL2566242 0.89 MAP2K1 (0.58) MAP2K1BRAFEIF2AK3MAP2K2
SCHEMBL4988785 0.88 MAP2K1 (0.42) MAP2K1BRAFEIF2AK3THRBKDM4E
SCHEMBL2565490 0.87 MAP2K1 (0.42) MAP2K1BRAFEIF2AK3KDM4ETP53
SCHEMBL2565053 0.86 MAP2K1 (0.44) MAP2K1BRAFEIF2AK3THRBMAP2K2
SCHEMBL2566055 0.85 MAP2K1 (0.53) MAP2K1BRAFEIF2AK3KDM4ELMNA
SCHEMBL2562264 0.84 MAP2K1 (0.40) MAP2K1BRAFEIF2AK3THRBTP53
SCHEMBL2577395 0.84 THRB (0.43) MAP2K1BRAFEIF2AK3THRBKDM4E

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-2069354-B1 Aza-benzofuranyl compounds and methods of use GENENTECH INC (US) 2011-11-02 EP disclosed
EP-2069354-A1 AZA-BENZOFURANYL COMPOUNDS AND METHODS OF USE Genentech, Inc. (US) 2009-06-17 EP disclosed
US-20080085886-A1 Anticancer and/or antiinflammatory activity, MEK (MAP kinase kinase) inhibitors; for example, 3-(2-Fluoro-4-iodo-phenylamino)-furo[3,2-c]pyridine-2-carboxylic acid ((R)-2,3-dihydroxy-propoxy)-amide GENENTECH, INC. 2008-04-10 US disclosed
US-20080085886-A1 Anticancer and/or antiinflammatory activity, MEK (MAP kinase kinase) inhibitors; for example, 3-(2-Fluoro-4-iodo-phenylamino)-furo[3,2-c]pyridine-2-carboxylic acid ((R)-2,3-dihydroxy-propoxy)-amide GENENTECH, INC. 2008-04-10 US disclosed
WO-2008024725-A1 AZA-BENZOFURANYL COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2008-02-28 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-20080085886-A1 Anticancer and/or antiinflammatory activity, MEK (MAP kinase kinase) inhibitors; for example, 3-(2-Fluoro-4-iodo-phenylamino)-furo[3,2-c]pyridine-2-carboxylic acid ((R)-2,3-dihydroxy-propoxy)-amide MAP3K2, MAP3K1, MAP2K2 MAP2K1 10/4885BRAF 42/4885EIF2AK3 463/4885

“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.