SCHEMBL8686338

SCHEMBL8686338

[O-][n+]1c2ccccc2[n+]([O-])c2cc(Cl)c(Cl)cc21

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
POLB P06746 1/20 0.56
CASP6 P55212 1/20 0.56
ATM Q13315 1/20 0.52
LMNA P02545 1/20 0.36
TSHR P16473 1/20 0.36
ALDH1A1 P00352 1/20 0.35
CRHBP P24387 1/20 0.34
CRHR2 Q13324 1/20 0.34
KEAP1 Q14145 1/20 0.34
NFE2L2 Q16236 1/20 0.34
CYP1A2 P05177 1/20 0.32
CYP2A6 P11509 1/20 0.32
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
S1PR4 O95977 1/20 0.32
MAPT P10636 1/20 0.32
S1PR1 P21453 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL6919829 0.81 ATM (0.63) MEN1KMT2APOLBCASP6ATM
SCHEMBL29627789 0.81 ATM (0.63) MEN1KMT2APOLBCASP6ATM
SCHEMBL8686850 0.76 MEN1 (0.43) MEN1KMT2APOLBCASP6ATM
SCHEMBL8785964 0.75 POLB (0.68) MEN1KMT2APOLBCASP6ATM
SCHEMBL8687527 0.75 MEN1 (0.56) MEN1KMT2APOLBCASP6ATM
SCHEMBL14344280 0.73 KMT2A (0.54) MEN1KMT2APOLBCASP6ATM
SCHEMBL8787510 0.71 MEN1 (0.57) MEN1KMT2APOLBCASP6ATM
SCHEMBL8785577 0.71 KMT2A (0.57) MEN1KMT2APOLBCASP6ATM
SCHEMBL8785885 0.71 MEN1 (1.00) MEN1KMT2APOLBCASP6ATM
SCHEMBL8784742 0.71 KMT2A (0.57) MEN1KMT2APOLBCASP6ATM

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-1998027969-A2 ANTIMICROBIAL PHENAZINE COMPOUNDS QUEEN'S UNIVERSITY AT KINGSTON (CA) 1998-07-02 WO disclosed