SCHEMBL9501110

SCHEMBL9501110

CS(=O)(=O)c1ccc(Oc2c(Cl)cc(N3NCC(=O)NC3=O)cc2Cl)cc1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 17/20 0.39
PTGS1 P23219 6/20 0.39
GCK P35557 1/20 0.35
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
SLC9A3 P48764 1/20 0.33

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
SCHEMBL9501834 0.84 LMNA (0.32)
SCHEMBL9504425 0.83 NPBWR1 (0.35) PTGS2
SCHEMBL9806719 0.82 PTGS2 (0.38) PTGS2PTGS1GCKCYP11B1CYP11B2
Sulazuril SCHEMBL8602617 0.79 PTGS2 (0.38) PTGS2PTGS1GCKCYP11B1CYP11B2
SCHEMBL9502409 0.77 THRB (0.44)
SCHEMBL9806715 0.76 PTGS2 (0.36) PTGS2PTGS1GCKCYP11B1CYP11B2
SCHEMBL9806752 0.75 PTGS2 (0.36) PTGS2PTGS1GCKCYP11B1CYP11B2
SCHEMBL15904417 0.70 PTGS2 (0.49) PTGS2PTGS1CYP11B1CYP11B2
SCHEMBL9500876 0.70 THRB (0.38) PTGS2
SCHEMBL9501104 0.70 THRB (0.60)

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-0154885-B1 SUBSTITUTED 2-PHENYL-HEXAHYDRO-1,2,4-TRIAZINE-2,5-DIONES, METHOD FOR THEIR PREPARATION, THEIR USE AS VETERINARY MEDICINES AND FOR COMBATING PROTOZOES HOECHST AKTIENGESELLSCHAFT (DE) 1989-01-18 EP claimed
US-5188832-A Triazine-dione compounds HOECHST AKTIENGESELLSCHAFT (DE) 1993-02-23 US disclosed
EP-0215354-B1 SUBSTITUTED 2-PHENYL-HEXAHYDRO-1,2,4-TRIAZINE-3,5-DIONES, PROCESS FOR THEIR PREPARATION, PRODUCTS CONTAINING THEM AND THEIR USE HOECHST AKTIENGESELLSCHAFT (DE) 1991-04-24 EP disclosed
EP-0383285-A2 Agent against fish and insect parasites HOECHST AKTIENGESELLSCHAFT (DE) 1990-08-22 EP disclosed
EP-0154885-B1 SUBSTITUTED 2-PHENYL-HEXAHYDRO-1,2,4-TRIAZINE-2,5-DIONES, METHOD FOR THEIR PREPARATION, THEIR USE AS VETERINARY MEDICINES AND FOR COMBATING PROTOZOES HOECHST AKTIENGESELLSCHAFT (DE) 1989-01-18 EP disclosed
US-4782056-A COCCIDIOSTATICS HOECHST AKTIENGESELLSCHAFT (DE) 1988-11-01 US disclosed
EP-0215354-A2 Substituted 2-phenyl-hexahydro-1,2,4-triazine-3,5-diones, process for their preparation, products containing them and their use HOECHST AKTIENGESELLSCHAFT (DE) 1987-03-25 EP disclosed