SCHEMBL7475466

SCHEMBL7475466

CC(C)(O)c1ccc(Cc2c(Cl)cc(-n3ncc(=O)[nH]c3=O)cc2Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRB P10828 12/20 0.52
THRA P10827 5/20 0.52
P2RX7 Q99572 7/20 0.44
MEN1 O00255 1/20 0.43
NR1I2 O75469 1/20 0.43
KMT2A Q03164 1/20 0.43
ABCB11 O95342 1/20 0.39

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
SCHEMBL7474453 0.94 THRB (0.46) THRBTHRAP2RX7MEN1NR1I2
SCHEMBL7484859 0.93 THRB (0.46) THRBTHRAP2RX7MEN1NR1I2
SCHEMBL7476813 0.91 THRB (0.49) THRBTHRAP2RX7MEN1NR1I2
SCHEMBL7481956 0.89 THRB (0.52) THRBTHRAP2RX7MEN1NR1I2
SCHEMBL7478245 0.87 THRB (0.42) THRBTHRAP2RX7MEN1NR1I2
SCHEMBL7829095 0.85 MEN1 (0.58) THRBTHRAP2RX7MEN1NR1I2
SCHEMBL7999085 0.84 THRB (0.53) THRBTHRAP2RX7MEN1NR1I2
SCHEMBL7477395 0.83 THRB (0.53) THRBTHRAP2RX7MEN1NR1I2
SCHEMBL24781304 0.83 THRB (0.55) THRBTHRAP2RX7MEN1NR1I2
SCHEMBL8347711 0.83 THRB (0.52) THRBTHRAP2RX7MEN1NR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0831088-B1 1,2,4-Triazine-3,5-dione derivatives as anticoccidial agents TAKEDA SCHERING PLOUGH ANIMAL (JP) 2002-11-27 EP claimed
US-5985875-A USEFUL AS ANTI-PROTOZOAL AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-11-16 US claimed
EP-0831088-A1 1,2,4-Triazine-3,5-dione derivatives as anticoccidial agents TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-03-25 EP claimed
EP-0831088-B1 1,2,4-Triazine-3,5-dione derivatives as anticoccidial agents TAKEDA SCHERING PLOUGH ANIMAL (JP) 2002-11-27 EP disclosed
US-5985875-A USEFUL AS ANTI-PROTOZOAL AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-11-16 US disclosed
EP-0831088-A1 1,2,4-Triazine-3,5-dione derivatives as anticoccidial agents TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-03-25 EP disclosed