SCHEMBL9501824

SCHEMBL9501824

CN1CC(=O)NC(=O)N1c1cc(Cl)c(Oc2ccc([S+](C)[O-])cc2)c(Cl)c1

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
NPBWR1 P48145 1/20 0.30
MCHR1 Q99705 1/20 0.30

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
Sulazuril SCHEMBL8602617 0.84 PTGS2 (0.38)
SCHEMBL9503269 0.83 NPBWR1 (0.35) LMNASMN1; SMN2NPSR1NPBWR1MCHR1
SCHEMBL9501834 0.79 LMNA (0.32) LMNASMN1; SMN2NPSR1NPBWR1MCHR1
SCHEMBL9503274 0.73
SCHEMBL9806752 0.72 PTGS2 (0.36)
SCHEMBL9806715 0.71 PTGS2 (0.36)
SCHEMBL9502393 0.70 THRB (0.55)
SCHEMBL9806729 0.70 NPBWR1 (0.33) LMNASMN1; SMN2NPSR1NPBWR1
SCHEMBL9502417 0.67 MEN1 (0.41) LMNANPSR1
SCHEMBL11651357 0.67 NPBWR1 (0.40) LMNASMN1; SMN2NPBWR1MCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5188832-A Triazine-dione compounds HOECHST AKTIENGESELLSCHAFT (DE) 1993-02-23 US disclosed
EP-0383285-A2 Agent against fish and insect parasites HOECHST AKTIENGESELLSCHAFT (DE) 1990-08-22 EP disclosed