SCHEMBL9806729

SCHEMBL9806729

CSc1ccc(Oc2c(Cl)cc(N3C(=O)NC(=O)CN3C=O)cc2Cl)cc1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPBWR1 P48145 1/20 0.33
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
LMNA P02545 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30
PTGS2 P35354 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
SCHEMBL9503269 0.86 NPBWR1 (0.35) NPBWR1NPC1RAB9ALMNASMN1; SMN2
SCHEMBL9806715 0.84 PTGS2 (0.36) PTGS2
SCHEMBL9504425 0.76 NPBWR1 (0.35) NPBWR1NPC1RAB9ALMNASMN1; SMN2
SCHEMBL9806750 0.73 NPBWR1 (0.35) NPBWR1NPC1RAB9ALMNASMN1; SMN2
SCHEMBL9501824 0.70 LMNA (0.31) NPBWR1LMNASMN1; SMN2NPSR1
Sulazuril SCHEMBL8602617 0.70 PTGS2 (0.38) PTGS2
SCHEMBL9806752 0.67 PTGS2 (0.36) NPC1PTGS2
SCHEMBL9503278 0.66 THRB (0.59)
SCHEMBL10501699 0.65 SLC6A4 (0.40) NPC1RAB9ASLC6A2SLC6A4SLC6A3
SCHEMBL11464658 0.65 SLC6A4 (0.42) NPBWR1SMN1; SMN2SLC6A2SLC6A4SLC6A3

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
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
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