SCHEMBL11832824

SCHEMBL11832824

CNC(=O)Nc1cc(Cl)c(Oc2ccc([N+](=O)[O-])cc2Cl)c(Cl)c1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.61
MEN1 O00255 8/20 0.61
GAA P10253 2/20 0.61
PKM P14618 1/20 0.61
MAPT P10636 8/20 0.54
LMNA P02545 6/20 0.54
ALDH1A1 P00352 6/20 0.54
HTT P42858 2/20 0.54
MAPK1 P28482 1/20 0.54
SMN1; SMN2 Q16637 5/20 0.51
RAB9A P51151 2/20 0.51
XBP1 P17861 1/20 0.51
CCR6 P51684 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
THRA P10827 2/20 0.49
CYP2C9 P11712 1/20 0.47
PDE7A Q13946 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
TDP1 Q9NUW8 1/20 0.45

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
SCHEMBL11827890 0.91 KMT2A (0.58) KMT2AMEN1GAAPKMMAPT
SCHEMBL11831710 0.91 KMT2A (0.50) KMT2AMEN1GAAPKMMAPT
SCHEMBL11827269 0.90 MEN1 (0.63) KMT2AMEN1GAAPKMMAPT
SCHEMBL11839070 0.87 KMT2A (0.57) KMT2AMEN1GAAPKMMAPT
SCHEMBL11832770 0.87 KMT2A (0.57) KMT2AMEN1GAAPKMMAPT
SCHEMBL11836660 0.85 KMT2A (0.55) KMT2AMEN1GAAPKMMAPT
SCHEMBL11842234 0.85 MEN1 (0.57) KMT2AMEN1GAAPKMMAPT
SCHEMBL11834832 0.84 RAB9A (0.56) KMT2AMEN1GAAPKMMAPT
SCHEMBL11824796 0.82 KMT2A (0.54) KMT2AMEN1GAAPKMMAPT
SCHEMBL11836808 0.81 MEN1 (0.42) KMT2AMEN1GAAPKMMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3933814-A ANTIPROTOZOA, ANTICOCCIDIOSIS BAYER AKTIENGESELLSCHAFT (DT) 1976-01-20 US disclosed