SCHEMBL720442

SCHEMBL720442

Cc1c(Nc2ccc(I)cc2F)c(NS(=O)(=O)C2CC2)cn(C)c1=O

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 19/20 0.51
BRAF P15056 1/20 0.47
MAP2K2 P36507 6/20 0.41

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
SCHEMBL1516527 0.91 MAP2K1 (0.45) MAP2K1BRAFMAP2K2
SCHEMBL18086455 0.90 BRAF (0.48) MAP2K1BRAF
SCHEMBL9284438 0.90 BRAF (0.48) MAP2K1BRAFMAP2K2
SCHEMBL1516512 0.89 BRAF (0.48) MAP2K1BRAFMAP2K2
SCHEMBL15700928 0.84 MAP2K1 (0.46) MAP2K1MAP2K2
SCHEMBL13113736 0.84 MAP2K1 (0.42) MAP2K1BRAFMAP2K2
SCHEMBL13113727 0.84 MAP2K1 (0.43) MAP2K1BRAFMAP2K2
SCHEMBL13113251 0.83 MAP2K1 (0.50) MAP2K1MAP2K2
SCHEMBL13113732 0.83 MAP2K1 (0.48) MAP2K1MAP2K2
SCHEMBL1516486 0.82 MAP2K1 (0.56) MAP2K1MAP2K2

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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120053211-A1 TREATMENT OF PANCREATIC CANCER ARDEA BIOSCIENCES, INC. (US) 2012-03-01 US claimed
EP-2405907-A1 TREATMENT OF PANCREATIC CANCER Ardea Biosciences, Inc. (US) 2012-01-18 EP claimed
WO-2010105082-A1 TREATMENT OF PANCREATIC CANCER ARDEA BIOSCIENCES, INC. (US) 2010-09-16 WO claimed
EP-2175885-B1 COMBINATIONS OF MEK INHIBITORS AND RAF KINASE INHIBITORS AND USES THEREOF ARDEA BIOSCIENCES INC (US) 2016-10-12 EP disclosed
US-20160271122-A1 COMBINATIONS OF MEK INHIBITORS AND RAF KINASE INHIBITORS AND USES THEREOF ARDEA BIOSCIENCES, INC. (US) 2016-09-22 US disclosed
US-20160271122-A1 COMBINATIONS OF MEK INHIBITORS AND RAF KINASE INHIBITORS AND USES THEREOF ARDEA BIOSCIENCES, INC. (US) 2016-09-22 US disclosed
US-20150267258-A1 BIOMARKERS FOR DETERMINING EFFECTIVE RESPONSE OF TREATMENTS OF HEPATOCELLULAR CARCINOMA (HCC) PATIENTS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-09-24 US disclosed
US-20150267258-A1 BIOMARKERS FOR DETERMINING EFFECTIVE RESPONSE OF TREATMENTS OF HEPATOCELLULAR CARCINOMA (HCC) PATIENTS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-09-24 US disclosed
US-20150265679-A1 METHOD OF REDUCING ADVERSE EFFECTS IN A CANCER PATIENT UNDREGOING TREATMENT WITH A MEK INHIBITOR THE UNITED STATES OF AMERICA, AS REPRESENTED BY SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2015-09-24 US disclosed
US-9095581-B2 Combinations of MEK inhibitors and Raf kinase inhibitors and uses thereof ARDEA BIOSCIENCES, INC. (US) 2015-08-04 US disclosed
US-9095581-B2 Combinations of MEK inhibitors and Raf kinase inhibitors and uses thereof ARDEA BIOSCIENCES, INC. (US) 2015-08-04 US disclosed
WO-2010105082-A1 TREATMENT OF PANCREATIC CANCER ARDEA BIOSCIENCES, INC. (US) 2010-09-16 WO disclosed
WO-2010105082-A1 TREATMENT OF PANCREATIC CANCER ARDEA BIOSCIENCES, INC. (US) 2010-09-16 WO disclosed
WO-2010105082-A1 TREATMENT OF PANCREATIC CANCER ARDEA BIOSCIENCES, INC. (US) 2010-09-16 WO disclosed
WO-2009018238-A1 COMBINATIONS OF MEK INHIBITORS AND RAF KINASE INHIBITORS AND USES THEREOF ARDEA BIOSCIENCES, INC. (US) 2009-02-05 WO disclosed
EP-2012786-A2 PYRIDONE SULFONAMIDES AND PYRIDONE SULFAMIDES AS MEK INHIBITORS Ardea Biosciences, Inc. (US) 2009-01-14 EP disclosed
WO-2007121481-A2 PYRIDONE SULFONAMIDES AND PYRIDONE SULFAMIDES AS MEK INHIBITORS ARDEA BIOSCIENCES, INC. (US) 2007-10-25 WO disclosed
US-20070244164-A1 PYRIDONE SULFONAMIDES AND PYRIDONE SULFAMIDES AS MEK INHIBITORS ARDEA BIOSCIENCES (US) 2007-10-18 US disclosed
US-20070244164-A1 PYRIDONE SULFONAMIDES AND PYRIDONE SULFAMIDES AS MEK INHIBITORS ARDEA BIOSCIENCES (US) 2007-10-18 US disclosed
US-20070244164-A1 PYRIDONE SULFONAMIDES AND PYRIDONE SULFAMIDES AS MEK INHIBITORS ARDEA BIOSCIENCES (US) 2007-10-18 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 (5 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-20120053211-A1 TREATMENT OF PANCREATIC CANCER KRAS, RNASE1, PKD1 MAP2K1 1901/4885BRAF 951/4885MAP2K2 2897/4885
US-20160271122-A1 COMBINATIONS OF MEK INHIBITORS AND RAF KINASE INHIBITORS AND USES THEREOF BRAF, RAF1, NRAS MAP2K1 71/4885BRAF 1/4885MAP2K2 74/4885
US-20150265679-A1 METHOD OF REDUCING ADVERSE EFFECTS IN A CANCER PATIENT UNDREGOING TREATMENT WITH A MEK INHIBITOR NRAS, BRAF, KRAS MAP2K1 259/4885BRAF 2/4885MAP2K2 209/4885
US-20150267258-A1 BIOMARKERS FOR DETERMINING EFFECTIVE RESPONSE OF TREATMENTS OF HEPATOCELLULAR CARCINOMA (HCC) PATIENTS NRAS, KRAS, TP53 MAP2K1 110/4885BRAF 6/4885MAP2K2 116/4885
US-20070244164-A1 PYRIDONE SULFONAMIDES AND PYRIDONE SULFAMIDES AS MEK INHIBITORS BRAF, PDXK, MAP3K20 MAP2K1 38/4885BRAF 1/4885MAP2K2 25/4885

“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.