SCHEMBL8107570

SCHEMBL8107570

CC(C)Oc1nc(F)cc2nc(S(=O)(=O)Nc3c(Cl)cccc3Cl)nn12

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 2/20 0.34
SCN5A Q14524 2/20 0.34
SCN8A Q9UQD0 2/20 0.34
TSHR P16473 1/20 0.33
ACLY P53396 1/20 0.33
CCR4 P51679 2/20 0.32
DHODH Q02127 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
SCHEMBL8113170 0.89 TSHR (0.39) TSHRCCR4
Diclosulam SCHEMBL116344 0.85 GNRHR (0.35) TSHRCCR4
SCHEMBL8848572 0.81 GNRHR (0.34) SCN1ASCN5ASCN8ATSHRACLY
SCHEMBL8113251 0.80 LMNA (0.37) TSHR
SCHEMBL910274 0.79 GAA (0.42) TSHRACLYCCR4
Diclosulam SCHEMBL2231960 0.78 CA2 (0.33) TSHR
SCHEMBL4890265 0.77 WDR5 (0.39) ACLYCCR4
SCHEMBL118467 0.77 WDR5 (0.39) ACLYCCR4
SCHEMBL26838562 0.77 CCR4 (0.34) SCN1ASCN5ASCN8ATSHRCCR4
SCHEMBL8111629 0.77 F7 (0.32) TSHRACLY

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6114580-A N-arylsulfilimine compounds and their use as catalysts in the preparation of N-arylarylsulfonamide compounds DOW AGROSCIENCES LLC (US) 2000-09-05 US disclosed
EP-0888297-B1 N-ARYLSULFILIMINE COMPOUNDS AND THEIR USE AS CATALYSTS IN THE PREPARATION OF N-ARYLARYLSULFONAMIDE COMPOUNDS DOW AGROSCIENCES LLC (US) 2000-08-30 EP disclosed
US-5973148-A N-arylsulfilimine compounds and their use as catalysts in the preparation of N-arylarylsulfonamide compounds DOW AGROSCIENCES LLC (US) 1999-10-26 US disclosed