SCHEMBL486695

SCHEMBL486695

Cn1c(Nc2ccc(I)cc2F)c(NS(=O)(=O)C2CC2)cc(F)c1=O

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 19/20 0.57
MAP2K2 P36507 5/20 0.42
MAP2K5 Q13163 1/20 0.42
EIF2AK1 Q9BQI3 1/20 0.42
ABCB1 P08183 1/20 0.40
BRAF P15056 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
SCHEMBL2701377 0.92 MAP2K1 (0.68) MAP2K1MAP2K2MAP2K5EIF2AK1ABCB1
SCHEMBL15579607 0.91 MAP2K1 (0.54) MAP2K1MAP2K2MAP2K5EIF2AK1ABCB1
SCHEMBL4402980 0.90 MAP2K1 (0.53) MAP2K1MAP2K2MAP2K5EIF2AK1ABCB1
SCHEMBL15579602 0.89 MAP2K1 (0.52) MAP2K1MAP2K2MAP2K5EIF2AK1ABCB1
SCHEMBL487030 0.88 MAP2K1 (0.50) MAP2K1MAP2K2MAP2K5EIF2AK1
SCHEMBL3803502 0.88 MAP2K1 (0.66) MAP2K1MAP2K2MAP2K5EIF2AK1ABCB1
SCHEMBL3806030 0.88 MAP2K1 (0.66) MAP2K1MAP2K2MAP2K5EIF2AK1ABCB1
SCHEMBL15579597 0.83 MAP2K1 (0.49) MAP2K1MAP2K2MAP2K5EIF2AK1ABCB1
SCHEMBL15579596 0.83 MAP2K1 (0.47) MAP2K1MAP2K2MAP2K5EIF2AK1ABCB1
SCHEMBL15579600 0.82 MAP2K1 (0.47) MAP2K1MAP2K2MAP2K5EIF2AK1ABCB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2411366-B1 DIHYDROPYRIDIN SULFONAMIDES AND DIHYDROPYRIDIN SULFAMIDES AS MEK INHIBITORS ARDEA BIOSCIENCES INC (US) 2015-05-20 EP disclosed
EP-2411366-B1 DIHYDROPYRIDIN SULFONAMIDES AND DIHYDROPYRIDIN SULFAMIDES AS MEK INHIBITORS ARDEA BIOSCIENCES INC (US) 2015-05-20 EP disclosed
US-8673919-B2 Dihydropyridin sulfonamides and dihydropyridin sulfamides as MEK inhibitors ARDEA BIOSCIENCES, INC. (US) 2014-03-18 US disclosed
US-8673919-B2 Dihydropyridin sulfonamides and dihydropyridin sulfamides as MEK inhibitors ARDEA BIOSCIENCES, INC. (US) 2014-03-18 US disclosed
US-20120107307-A1 DIHYDROPYRIDIN SULFONAMIDES AND DIHYDROPYRIDIN SULFAMIDES AS MEK INHIBITORS ARDEA BIOSCIENCES INC. (US) 2012-05-03 US disclosed
US-20120107307-A1 DIHYDROPYRIDIN SULFONAMIDES AND DIHYDROPYRIDIN SULFAMIDES AS MEK INHIBITORS ARDEA BIOSCIENCES INC. (US) 2012-05-03 US disclosed
EP-2411366-A1 DIHYDROPYRIDIN SULFONAMIDES AND DIHYDROPYRIDIN SULFAMIDES AS MEK INHIBITORS Ardea Biosciences, Inc. (US) 2012-02-01 EP disclosed
WO-2010108652-A1 DIHYDROPYRIDIN SULFONAMIDES AND DIHYDROPYRIDIN SULFAMIDES AS MEK INHIBITORS ARDEA BIOSCIENCES INC. (US) 2010-09-30 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-20120107307-A1 DIHYDROPYRIDIN SULFONAMIDES AND DIHYDROPYRIDIN SULFAMIDES AS MEK INHIBITORS BRAF, NRAS, MAP3K12 MAP2K1 59/4885MAP2K2 52/4885MAP2K5 67/4885

“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.