SCHEMBL6727322

SCHEMBL6727322

CCSc1cccc(OC(F)(F)F)c1S(=O)(=O)NC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.35
HPGD P15428 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
NPC1 O15118 1/20 0.35
LMNA P02545 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SLC40A1 Q9NP59 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
BRD4 O60885 1/20 0.33
ALPL P05186 1/20 0.33
NSD2 O96028 2/20 0.33
RXFP1 Q9HBX9 1/20 0.32
SLC22A12 Q96S37 4/20 0.32
AR P10275 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL6730933 0.82 ALOX15 (0.35) HPGDRXFP1ARKDM2BF2R
SCHEMBL6738181 0.79 MAPT (0.40) MAPTHPGDKDM4EMEN1NPC1
SCHEMBL27466464 0.74 AR (0.32) RXFP1AR
SCHEMBL27467844 0.74 AR (0.30) AR
SCHEMBL27467845 0.72
SCHEMBL6737493 0.72 NSD2 (0.44) MAPTHPGDKDM4EMEN1NPC1
SCHEMBL6735794 0.72 ALPL (0.51) MAPTHPGDKDM4EMEN1NPC1
SCHEMBL6727323 0.72 SMN1; SMN2 (0.41) MAPTHPGDKDM4EMEN1NPC1
SCHEMBL10572395 0.67 SMN1; SMN2 (0.47) MAPTHPGDKDM4EMEN1NPC1
SCHEMBL8412566 0.64 HCRTR1 (0.37) CYP2C9KDM2BF2R

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
US-6677277-B1 Substituted sulphonyl amino(thio)carbonyl compounds and their use as herbicides BAYER AKTIENGESELLSCHAFT (DE) 2004-01-13 US disclosed
EP-0906293-B1 SUBSTITUTED SULPHONYL AMINO(THIO)CARBONYL COMPOUNDS AND THEIR USE AS HERBICIDES BAYER CROPSCIENCE AG (DE) 2003-09-17 EP disclosed
EP-0906293-A1 SUBSTITUTED SULPHONYL AMINO(THIO)CARBONYL COMPOUNDS AND THEIR USE AS HERBICIDES BAYER AG (DE) 1999-04-07 EP disclosed
WO-1997046540-A1 SUBSTITUTED SULPHONYL AMINO(THIO)CARBONYL COMPOUNDS AND THEIR USE AS HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-12-11 WO disclosed