SCHEMBL8000281

SCHEMBL8000281

Cc1ccc(C(=O)c2ccc(Cc3c(Cl)cc([N+](=O)[O-])cc3Cl)cc2)cn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPT P10636 6/20 0.45
MAPK1 P28482 3/20 0.45
TDP1 Q9NUW8 2/20 0.45
POLB P06746 1/20 0.45
NPSR1 Q6W5P4 2/20 0.42
KDM4E B2RXH2 2/20 0.42
GAA P10253 2/20 0.42
HTT P42858 2/20 0.42
ALDH1A1 P00352 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
CCR9 P51686 3/20 0.39
VCAM1 P19320 2/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.36
RAF1 P04049 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL8005114 0.88 MAPT (0.44) MEN1KMT2AMAPTMAPK1TDP1
SCHEMBL8005176 0.86 TDP1 (0.43) MEN1KMT2AMAPTMAPK1TDP1
SCHEMBL8002136 0.86 MAPT (0.43) MEN1KMT2AMAPTMAPK1TDP1
SCHEMBL8002481 0.86 SRD5A2 (0.49) MEN1KMT2AMAPTMAPK1TDP1
SCHEMBL7989865 0.85 MAPT (0.43) MEN1KMT2AMAPTMAPK1TDP1
SCHEMBL8000191 0.83 CCR9 (0.39) KMT2ANPSR1KDM4ECCR9SRD5A2
SCHEMBL7483341 0.83 MAPT (0.46) MEN1KMT2AMAPTMAPK1TDP1
SCHEMBL8002367 0.81 MAPT (0.40) MEN1KMT2AMAPTMAPK1TDP1
SCHEMBL8001948 0.81 L3MBTL1 (0.44) MEN1KMT2AMAPTMAPK1TDP1
SCHEMBL7841868 0.79 MAPK1 (0.54) MEN1KMT2AMAPTMAPK1TDP1

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-6294536-B1 CONTROL OF PROTOZOA AND REDUCTION IN THE INCIDENCE OF ASSOCIATED DISEASES AND DEATH AND CONSEQUENT IMPROVEMENT IN RETARDED GROWTH AND GENERAL CONDITION AND PREVENTING DECREASE GROWTH AND GENERAL CONDITION TAKEDA SCHERING-PLOUGH ANIMAL HEALTH K.K. (JP) 2001-09-25 US disclosed