SCHEMBL11079756

SCHEMBL11079756

O=C1CNN(Cc2ccc(Cl)c(Cl)c2)C(=O)N1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.44
POLB P06746 1/20 0.44
SIGMAR1 Q99720 2/20 0.43
DBH P09172 1/20 0.42
APAF1 O14727 2/20 0.40
ALDH1A1 P00352 1/20 0.40
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40
BCHE P06276 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
ALOX12 P18054 1/20 0.40
ACHE P22303 1/20 0.40
CES1 P23141 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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 0.84 KMT2A (0.44) KMT2ASIGMAR1DBHALDH1A1MAPT
SCHEMBL11082068 0.83 KMT2A (0.43) KMT2ASIGMAR1DBHALDH1A1MAPT
SCHEMBL11089788 0.81 MAPT (0.51) KMT2ASMN1; SMN2SIGMAR1DBHCYP1A2
SCHEMBL11075283 0.80 SMN1; SMN2 (0.45) KMT2ASMN1; SMN2POLBALDH1A1TP53
SCHEMBL11084167 0.76 USP2 (0.43) KMT2ASMN1; SMN2ALDH1A1CYP1A2CYP3A4
SCHEMBL11079280 0.75 KMT2A (0.51) KMT2ASMN1; SMN2POLBALDH1A1TP53
SCHEMBL11290437 0.75 DBH (0.43) KMT2ASMN1; SMN2POLBSIGMAR1DBH
SCHEMBL11285216 0.74 SMN1; SMN2 (0.49) KMT2ASMN1; SMN2POLBSIGMAR1ALDH1A1
SCHEMBL11079219 0.71 KMT2A (0.44) KMT2ASMN1; SMN2POLBSIGMAR1APAF1
SCHEMBL11073959 0.71 KMT2A (0.41) KMT2ASMN1; SMN2POLBSIGMAR1DBH

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-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