SCHEMBL7484871

SCHEMBL7484871

CC(=O)c1ccc(Cc2c(Cl)cc(-n3ncc(=O)n(C)c3=O)cc2Cl)cc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 2/20 0.42
KMT2A Q03164 1/20 0.39
AR P10275 7/20 0.37
LMNA P02545 1/20 0.36
THRA P10827 2/20 0.35
THRB P10828 2/20 0.35
TSHR P16473 2/20 0.34
SMO Q99835 1/20 0.34
NPBWR1 P48145 1/20 0.33
POLB P06746 2/20 0.32
TP53 P04637 1/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL7481801 0.88 KMT2A (0.38) P2RX7KMT2AARLMNATHRA
SCHEMBL8002833 0.86 P2RX7 (0.39) P2RX7KMT2AARLMNATHRA
SCHEMBL7480013 0.85 P2RX7 (0.41) P2RX7KMT2AARTHRATHRB
SCHEMBL7480005 0.83 P2RX7 (0.39) P2RX7KMT2AARTHRATHRB
SCHEMBL7477804 0.77 THRB (0.47) P2RX7KMT2ATHRATHRB
SCHEMBL7480097 0.76 NPBWR1 (0.34) P2RX7KMT2AARTHRATHRB
SCHEMBL8347711 0.72 THRB (0.52) P2RX7KMT2ATHRATHRB
SCHEMBL7472949 0.70 MEN1 (0.51) P2RX7KMT2ATHRATHRB
SCHEMBL7838560 0.70 KMT2A (0.56) KMT2ALMNATSHRALDH1A1MAPT
SCHEMBL7839566 0.69 KMT2A (0.39) KMT2AARLMNATSHRPOLB

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-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