SCHEMBL6310409

SCHEMBL6310409

CCS(=O)(=O)Nc1cc(-n2nc(C(F)F)n(C)c2=O)c(F)cc1C#N

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PGR P06401 5/20 0.39
AR P10275 1/20 0.39
DHODH Q02127 14/20 0.37
BRD4 O60885 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
SCHEMBL6316627 0.90 PPOX (0.40) PGRDHODH
SCHEMBL6310920 0.89 PGR (0.35) PGRARDHODHBRD4
SCHEMBL6104604 0.89 PGR (0.39) PGRARBRD4
SCHEMBL6308458 0.85 PGR (0.40) PGRARDHODHBRD4
SCHEMBL7157679 0.84 PGR (0.39) PGRARDHODHBRD4
Potassium SCHEMBL7157685 0.84 PGR (0.39) PGRARDHODHBRD4
SCHEMBL6174842 0.82 PGR (0.41) PGRARBRD4
SCHEMBL6307815 0.81 PPOX (0.38) DHODH
SCHEMBL6309209 0.80 DHODH (0.43) DHODH
SCHEMBL7941767 0.80 PGR (0.36) PGRARDHODHBRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1221848-A1 SELECTIVE HERBICIDES ON THE BASIS OF N-ARYL-TRIAZOLINE(THI)ONES Bayer Aktiengesellschaft (DE) 2002-07-17 EP claimed
WO-2001022819-A1 SELECTIVE HERBICIDES ON THE BASIS OF N-ARYL-TRIAZOLINE(THI)ONES BAYER AKTIENGESELLSCHAFT (DE) 2001-04-05 WO claimed
US-6841517-B1 Selective herbicides on basis of N-aryl-triazoline(thi)ones BAYER AKTIENGESELLSCHAFT (DE) 2005-01-11 US disclosed
EP-1049376-B1 SELECTIVE HERBICIDES BASED ON N-ARYL- TRIAZOLINE(THI)ONS AND N-ARLYSULFONYLAMINO (THIO)CARBONYL- TRIAZOLINE(THI) ONS BAYER AG (DE) 2002-10-16 EP disclosed
EP-1221848-A1 SELECTIVE HERBICIDES ON THE BASIS OF N-ARYL-TRIAZOLINE(THI)ONES Bayer Aktiengesellschaft (DE) 2002-07-17 EP disclosed
US-6297192-B1 MIXTURES OF HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 2001-10-02 US disclosed
WO-2001022819-A1 SELECTIVE HERBICIDES ON THE BASIS OF N-ARYL-TRIAZOLINE(THI)ONES BAYER AKTIENGESELLSCHAFT (DE) 2001-04-05 WO disclosed