SCHEMBL9389526

SCHEMBL9389526

N#Cc1nc2cc(OC(F)F)c(Cl)cc2[nH]1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PSMB8 P28062 2/20 0.49
▸ RHEB Q15382 3/20 0.38
▸ AR P10275 4/20 0.34
▸ GAA P10253 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ ATP4A P20648 3/20 0.33
▸ ATP4B P51164 3/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ TTR P02766 1/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ HTT P42858 1/20 0.32
▸ ATP1A1 P05023 1/20 0.31
▸ ATP1B1 P05026 1/20 0.31
▸ ATP1A3 P13637 1/20 0.31
▸ ATP1B2 P14415 1/20 0.31
▸ ATP1A2 P50993 1/20 0.31
▸ ATP1B3 P54709 1/20 0.31

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
SCHEMBL9389516 0.94 PSMB8 (0.49) PSMB8RHEBARGAAKDM4E
SCHEMBL10627035 0.78 PSMB8 (0.64) PSMB8RHEBARGAAMEN1
SCHEMBL5904354 0.69 PSMB8 (0.54) PSMB8RHEBARKDM4EMAPT
SCHEMBL29935431 0.67 PSMB8 (0.56) PSMB8RHEBGAAKDM4EMEN1
SCHEMBL10958881 0.66 PSMB8 (1.00) PSMB8KDM4EMEN1MAPTKMT2A
SCHEMBL10958865 0.66 PSMB8 (0.75) PSMB8RHEBGAAKDM4EMEN1
Lithium SCHEMBL30899067 0.65 PSMB8 (0.54) PSMB8RHEBGAAKDM4EMEN1
Lithium Ion SCHEMBL29942329 0.65 PSMB8 (0.54) PSMB8RHEBGAAKDM4EMEN1
SCHEMBL29216479 0.65 PSMB8 (0.54) PSMB8RHEBGAAKDM4EMEN1
SCHEMBL22853019 0.65 TRPV4 (0.39) MEN1MAPTKMT2ANPSR1HTT

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-1994018173-A1 BENZIMIDAZOLESULFONIC ACID DERIVATIVES AS MICROBICIDES CIBA-GEIGY AG (CH) 1994-08-18 — — WO disclosed
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