SCHEMBL466209

SCHEMBL466209

COc1cc(F)c(F)c(Nc2ccc(I)cc2F)c1C(O)C(O)CNS(=O)(=O)C1CC1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 19/20 0.52
MAP2K2 P36507 8/20 0.52
CHEK1 O14757 1/20 0.52
MAPK10 P53779 1/20 0.52
PRKAG1 P54619 1/20 0.52
ADCK1 Q86TW2 1/20 0.52
PRKAG2 Q9UGJ0 1/20 0.52
CA2 P00918 3/20 0.40
BRAF P15056 1/20 0.38
MAPK1 P28482 1/20 0.38
MAP2K5 Q13163 1/20 0.38
PIM1 P11309 1/20 0.36
CAMK2B Q13554 1/20 0.36

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
SCHEMBL15111098 1.00 MAP2K1 (0.52) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
SCHEMBL21142972 1.00 MAP2K1 (0.52) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
SCHEMBL15537286 0.91 MAP2K1 (0.53) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
SCHEMBL5025825 0.91 MAP2K1 (0.45) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
SCHEMBL5023528 0.91 MAP2K1 (0.54) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
SCHEMBL1527813 0.88 MAP2K1 (0.42) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
SCHEMBL1527738 0.83 MAP2K1 (0.45) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
SCHEMBL28704528 0.83 MAP2K1 (0.51) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
SCHEMBL23037463 0.81 MAP2K1 (0.61) MAP2K1MAP2K2CHEK1MAPK10PRKAG1
SCHEMBL685422 0.80 MAP2K1 (0.61) MAP2K1MAP2K2CHEK1MAPK10PRKAG1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4398904-A1 SELECTED COMPOUNDS FOR TARGETED DEGRADATION OF BRD9 C4 Therapeutics, Inc. (US) 2024-07-17 EP disclosed
EP-4228624-A1 TRICYCLIC COMPOUNDS TO DEGRADE NEOSUBSTRATES FOR MEDICAL THERAPY C4 Therapeutics, Inc. (US) 2023-08-23 EP disclosed
EP-4228625-A1 TRICYCLIC HETEROBIFUNCTIONAL COMPOUNDS FOR DEGRADATION OF TARGETED PROTEINS C4 Therapeutics, Inc. (US) 2023-08-23 EP disclosed
EP-4228639-A1 TRICYCLIC LIGANDS FOR DEGRADATION OF IKZF2 OR IKZF4 C4 Therapeutics, Inc. (US) 2023-08-23 EP disclosed
WO-2023154417-A1 MORPHIC FORMS OF CFT7455 AND METHODS OF MANUFACTURE THEREOF C4 THERAPEUTICS, INC. (US) 2023-08-17 WO disclosed
EP-4164653-A1 MORPHIC FORMS OF TRILACICLIB AND METHODS OF MANUFACTURE THEREOF G1 Therapeutics, Inc. (US) 2023-04-19 EP disclosed
WO-2023039208-A1 SELECTED COMPOUNDS FOR TARGETED DEGRADATION OF BRD9 C4 THERAPEUTICS, INC. (US) 2023-03-16 WO disclosed
WO-2023034336-A2 IMPROVED TREATMENTS FOR ADVANCED/METASTATIC CANCERS WITH CHECKPOINT INHIBITOR RESISTANCE OR RESISTANCE SUSCEPTIBILITY G1 THERAPEUTICS, INC. (US) 2023-03-09 WO disclosed
WO-2022081927-A1 TRICYCLIC COMPOUNDS TO DEGRADE NEOSUBSTRATES FOR MEDICAL THERAPY C4 THERAPEUTICS, INC. (US) 2022-04-21 WO disclosed
WO-2022081925-A1 TRICYCLIC LIGANDS FOR DEGRADATION OF IKZF2 OR IKZF4 C4 THERAPEUTICS, INC. (US) 2022-04-21 WO disclosed
EP-2462111-A1 PREPARATION OF (R)- AND (S)-N-(3, 4-DIFLUORO-2-(2-FLUORO-4-IODOPHENYLAMINO)--6-METHOXYPHENYL) -1- (2, 3-DIHYDROXYPROPYL)CYCLOPROPANE-1-SULFONAMIDE AND PROTECTED DERIVATIVES THEREOF Ardea Biosciences, Inc. (US) 2012-06-13 EP disclosed
CN-102421427-A Pharmaceutical combination comprising RDEA119/BAY869766 for the treatment of specific cancers ARDEA BIOSCIENCES INC 2012-04-18 CN disclosed
EP-2405908-A1 PHARMACEUTICAL COMBINATIONS COMPRISING RDEA119/BAY 869766 FOR THE TREATMENT OF SPECIFIC CANCERS Ardea Biosciences, Inc. (US) 2012-01-18 EP disclosed
EP-2405908-A1 PHARMACEUTICAL COMBINATIONS COMPRISING RDEA119/BAY 869766 FOR THE TREATMENT OF SPECIFIC CANCERS Ardea Biosciences, Inc. (US) 2012-01-18 EP disclosed
WO-2011161216-A1 HETEROARYL COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS NOVARTIS AG (CH) 2011-12-29 WO disclosed
WO-2011009541-A1 PREPARATION OF (R)- AND (S)-N-(3, 4-DIFLUORO-2-(2-FLUORO-4-IODOPHENYLAMINO)--6-METHOXYPHENYL) -1- (2, 3-DIHYDROXYPROPYL)CYCLOPROPANE-1-SULFONAMIDE AND PROTECTED DERIVATIVES THEREOF ARDEA BIOSCIENCES, INC. (US) 2011-01-27 WO disclosed
WO-2010105110-A1 PHARMACEUTICAL COMBINATIONS COMPRISING RDEA119/BAY 869766 FOR THE TREATMENT OF SPECIFIC CANCERS ARDEA BIOSCIENCES, INC. (US) 2010-09-16 WO disclosed
WO-2010105110-A1 PHARMACEUTICAL COMBINATIONS COMPRISING RDEA119/BAY 869766 FOR THE TREATMENT OF SPECIFIC CANCERS ARDEA BIOSCIENCES, INC. (US) 2010-09-16 WO disclosed
EP-2184984-A1 DERIVATIVES OF N-(ARYLAMINO) SULFONAMIDES INCLUDING POLYMORPHS AS INHIBITORS OF MEK AS WELL AS COMPOSITIONS, METHODS OF USE AND METHODS FOR PREPARING THE SAME Ardea Biosciences, Inc. (US) 2010-05-19 EP disclosed
WO-2009018233-A1 DERIVATIVES OF N-(ARYLAMINO) SULFONAMIDES INCLUDING POLYMORPHS AS INHIBITORS OF MEK AS WELL AS COMPOSITIONS, METHODS OF USE AND METHODS FOR PREPARING THE SAME ARDEA BIOSCIENCES, INC. (US) 2009-02-05 WO disclosed