SCHEMBL11082068

SCHEMBL11082068

O=C1CNN(Cc2ccc(Cl)cc2)C(=O)N1.[NaH]

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
SIGMAR1 Q99720 2/20 0.36
DRD2 P14416 2/20 0.36
DRD4 P21917 2/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
DBH P09172 1/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35
ERCC1 P07992 1/20 0.35
ERCC4 Q92889 1/20 0.35
TSHR P16473 1/20 0.35
HTR1A P08908 1/20 0.34
CHRM5 P08912 1/20 0.34
ADRA2A P08913 1/20 0.34

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
SCHEMBL11081247 0.98 KMT2A (0.44) KMT2AMEN1ALDH1A1KDM4ESIGMAR1
SCHEMBL11075283 0.83 SMN1; SMN2 (0.45) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL11085801 0.83 DDB1 (0.51) KMT2AMEN1ALDH1A1KDM4ESIGMAR1
SCHEMBL11079756 0.83 KMT2A (0.47) KMT2AALDH1A1SIGMAR1MAPTDBH
SCHEMBL11290437 0.81 DBH (0.43) KMT2AMEN1ALDH1A1KDM4ESIGMAR1
SCHEMBL11089788 0.81 MAPT (0.51) KMT2AMEN1KDM4ESIGMAR1MAPT
SCHEMBL11084167 0.80 USP2 (0.43) KMT2AMEN1ALDH1A1TSHR
SCHEMBL11080183 0.80 MEN1 (0.57) KMT2AMEN1ALDH1A1KDM4ESIGMAR1
SCHEMBL11285216 0.78 SMN1; SMN2 (0.49) KMT2AMEN1ALDH1A1KDM4ESIGMAR1
SCHEMBL11079280 0.72 KMT2A (0.51) KMT2AMEN1ALDH1A1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4426522-A ANTICOCCIDIAL ABIC LTD. (IL) 1984-01-17 US claimed
EP-0058534-A2 Hexahydro-1,2,4-triazine-3,5-dione derivatives and their use as feed additives ABIC LTD. (IL) 1982-08-25 EP claimed
US-4426522-A ANTICOCCIDIAL ABIC LTD. (IL) 1984-01-17 US disclosed
EP-0058534-A2 Hexahydro-1,2,4-triazine-3,5-dione derivatives and their use as feed additives ABIC LTD. (IL) 1982-08-25 EP disclosed