SCHEMBL28519683

SCHEMBL28519683

Cc1cccc2c1nc1ccccc1[n+]2[O-]

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.47
CRHR2 Q13324 1/20 0.47
KEAP1 Q14145 1/20 0.47
NFE2L2 Q16236 1/20 0.47
ATM Q13315 1/20 0.39
RAB9A P51151 4/20 0.38
NPC1 O15118 3/20 0.38
MEN1 O00255 1/20 0.38
HCRTR1 O43613 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 4/20 0.38
GAA P10253 2/20 0.38
MAPT P10636 6/20 0.37
MAPK1 P28482 2/20 0.37
TDP1 Q9NUW8 1/20 0.36
NQO2 P16083 4/20 0.35
HPGD P15428 2/20 0.35
KDM1A O60341 1/20 0.35
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL15780725 0.80 CRHBP (0.49) CRHBPCRHR2KEAP1NFE2L2ATM
SCHEMBL8687444 0.79 ACHE (0.53) CRHBPCRHR2KEAP1NFE2L2ATM
SCHEMBL29359446 0.78 CRHBP (0.61) CRHBPCRHR2KEAP1NFE2L2ATM
SCHEMBL51330 0.78 CRHBP (0.61) CRHBPCRHR2KEAP1NFE2L2ATM
SCHEMBL11532423 0.73 MEN1 (0.50) CRHBPCRHR2KEAP1NFE2L2RAB9A
SCHEMBL10865681 0.73 ALDH1A1 (0.58) CRHBPCRHR2KEAP1NFE2L2RAB9A
SCHEMBL30380175 0.72 CRHBP (0.47) CRHBPCRHR2KEAP1NFE2L2ATM
SCHEMBL28425031 0.71 POLB (0.45) CRHBPCRHR2KEAP1NFE2L2RAB9A
SCHEMBL28532290 0.71 CRHBP (0.64) CRHBPCRHR2KEAP1NFE2L2ATM
SCHEMBL20475325 0.71 RAB9A (0.53) RAB9ANPC1MEN1HCRTR1KMT2A

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
CN-107915687-B High-efficiency preparation method of polysubstituted phenazine derivative and oxide thereof 清华大学 2021-02-26 CN disclosed