SCHEMBL6263779

SCHEMBL6263779

NS(=O)(=O)c1ccc(CCNc2ncnc3c2cnn3-c2ccc(Cl)cc2Cl)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.76
TP53 P04637 11/20 0.76
ALDH1A1 P00352 2/20 0.64
KDM4E B2RXH2 1/20 0.64
MEN1 O00255 1/20 0.64
GAA P10253 1/20 0.64
KMT2A Q03164 1/20 0.64
LMNA P02545 7/20 0.58
POLB P06746 2/20 0.53
HTT P42858 1/20 0.49
NPC1 O15118 1/20 0.49
HPGD P15428 1/20 0.49
TSHR P16473 1/20 0.49
NFKB1 P19838 1/20 0.49
CASP3 P42574 1/20 0.49
RAB9A P51151 1/20 0.49
NFKB2 Q00653 1/20 0.49
RELA Q04206 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49

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
SCHEMBL6268635 0.86 MAPT (1.00) MAPTTP53ALDH1A1KDM4EMEN1
SCHEMBL6264705 0.84 MAPT (0.75) MAPTTP53ALDH1A1KDM4EMEN1
SCHEMBL6270710 0.81 MAPT (0.71) MAPTTP53ALDH1A1KDM4EMEN1
SCHEMBL6264746 0.79 MAPT (0.64) MAPTTP53ALDH1A1KDM4EMEN1
SCHEMBL17474420 0.78 MAPT (1.00) MAPTTP53ALDH1A1KDM4EMEN1
SCHEMBL6268057 0.76 TP53 (0.71) MAPTTP53ALDH1A1KDM4EGAA
SCHEMBL6267962 0.76 MAPT (0.56) MAPTTP53ALDH1A1LMNAPOLB
SCHEMBL17474394 0.71 MAPT (0.84) MAPTTP53ALDH1A1KDM4EMEN1
SCHEMBL23579671 0.71 KDM4E (0.75) MAPTTP53ALDH1A1KDM4EMEN1
SCHEMBL30032758 0.71 KDM4E (0.75) MAPTTP53ALDH1A1KDM4EMEN1

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
WO-2005047288-A1 PYRAZOLOPYRIMIDINES AS ANTI - HEPATITS C AGENTS ARROW THERAPEUTICS LIMITED (GB) 2005-05-26 WO disclosed