SCHEMBL9823730

SCHEMBL9823730

N#CC(c1ccc(Cl)cc1)c1c(Cl)cc(-n2ncc(=O)n(C/C=C/c3ccccc3)c2=O)cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
NR1I2 O75469 1/20 0.52
TP53 P04637 3/20 0.37
GAA P10253 2/20 0.37
ALDH1A1 P00352 3/20 0.34
ALDH2 P05091 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
LMNA P02545 3/20 0.32
BCL2A1 Q16548 1/20 0.32
MAPT P10636 2/20 0.31
USP2 O75604 1/20 0.31
POLB P06746 1/20 0.31
HPGD P15428 2/20 0.31
HTT P42858 1/20 0.31
KDM4E B2RXH2 1/20 0.31
GLA P06280 1/20 0.31

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
SCHEMBL10394514 0.85 MEN1 (0.58) MEN1KMT2ANR1I2GAAALDH1A1
SCHEMBL27278211 0.77 TP53 (0.40) MEN1KMT2ATP53GAAALDH1A1
SCHEMBL10395312 0.77 MEN1 (0.67) MEN1KMT2ANR1I2GAAALDH1A1
SCHEMBL7919164 0.71 MEN1 (0.65) MEN1KMT2ANR1I2GAAALDH1A1
SCHEMBL7919562 0.70 MEN1 (0.67) MEN1KMT2ANR1I2GAAALDH1A1
Diclazuril SCHEMBL126138 0.69 MEN1 (1.00) MEN1KMT2ANR1I2L3MBTL1
Diclazuril SCHEMBL27803573 0.69 MEN1 (0.64) MEN1KMT2ANR1I2GAAALDH1A1
SCHEMBL5566062 0.67 MEN1 (0.42) MEN1KMT2ANR1I2L3MBTL1LMNA
SCHEMBL7919703 0.64 MEN1 (0.86) MEN1KMT2ANR1I2L3MBTL1
SCHEMBL7917028 0.62 MEN1 (0.69) MEN1KMT2ANR1I2GAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0232932-B1 5,6-DIHYDRO-2-(SUBSTITUTED PHENYL)-1,2,4-TRIAZINE-3,5(2H,4H)-DIONES JANSSEN PHARMACEUTICA N.V. (BE) 1991-01-02 EP disclosed
US-4952570-A ANTIPROTOZOA AGENTS; COCCIDIOSIS JANSSEN PHARMACEUTICA N.V. (BE) 1990-08-28 US disclosed
US-4912106-A 5,6-Dihydro-2-(substituted phenyl)-1,2,4-triazine-3,5,(2H,4H)-diones and their use as protozoa combating agents JANSSEN PHARMACEUTICA N. V. FRAME-319 (BE) 1990-03-27 US disclosed
US-4767760-A Anti-protozoal 5,6-dihydro-2-(substituted phenyl)-1,2,4-triazine-3,5(2H,4H)-dione derivatives, compositions, and method of use therefor JANSSEN PHARMACUETICA N.V. (BE) 1988-08-30 US disclosed
EP-0232932-A1 5,6-Dihydro-2-(substituted phenyl)-1,2,4-triazine-3,5(2H,4H)-diones JANSSEN PHARMACEUTICA N.V. (BE) 1987-08-19 EP disclosed