SCHEMBL2559797

SCHEMBL2559797

CC(ONC(=O)c1oc2ccncc2c1Nc1ccc(I)cc1F)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 12/20 0.67
BRAF P15056 3/20 0.39
EIF2AK3 Q9NZJ5 3/20 0.39
MAP2K2 P36507 3/20 0.39
PRKCZ Q05513 1/20 0.39
IARS2 Q9NSE4 1/20 0.39
ROCK2 O75116 1/20 0.37
IDO1 P14902 1/20 0.36
KCNH2 Q12809 3/20 0.36
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL2562781 0.90 MAP2K1 (0.73) MAP2K1BRAFEIF2AK3MAP2K2PRKCZ
SCHEMBL2569337 0.88 MAP2K1 (0.77) MAP2K1BRAFMAP2K2PRKCZIARS2
SCHEMBL2566791 0.86 MAP2K1 (0.75) MAP2K1BRAFEIF2AK3MAP2K2PRKCZ
SCHEMBL2564064 0.85 MAP2K1 (0.72) MAP2K1BRAFEIF2AK3MAP2K2PRKCZ
SCHEMBL12164611 0.85 MAP2K1 (0.77) MAP2K1BRAFEIF2AK3MAP2K2PRKCZ
SCHEMBL2566228 0.85 MAP2K1 (0.71) MAP2K1BRAFEIF2AK3MAP2K2PRKCZ
SCHEMBL2567815 0.84 MAP2K1 (0.81) MAP2K1BRAFMAP2K2PRKCZIARS2
SCHEMBL2568326 0.83 MAP2K1 (0.83) MAP2K1BRAFMAP2K2PRKCZIARS2
SCHEMBL2565628 0.83 MAP2K1 (0.83) MAP2K1BRAFMAP2K2PRKCZIARS2
SCHEMBL2560086 0.83 MAP2K1 (0.83) MAP2K1BRAFMAP2K2PRKCZIARS2

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 4 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 claimed
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
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

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.