SCHEMBL11753243

SCHEMBL11753243

Nc1ccc(-c2nc3cc(Cl)c(N)c(Cl)c3s2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 12/20 0.50
▸ MAPT P10636 8/20 0.50
▸ GAA P10253 7/20 0.50
▸ KDM4E B2RXH2 6/20 0.50
▸ NPC1 O15118 5/20 0.50
▸ RAB9A P51151 5/20 0.50
▸ ALDH1A1 P00352 5/20 0.50
▸ GLA P06280 4/20 0.50
▸ POLB P06746 3/20 0.50
▸ MEN1 O00255 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ NFKB1 P19838 2/20 0.50
▸ GFER P55789 2/20 0.50
▸ NFKB2 Q00653 2/20 0.50
▸ RELA Q04206 2/20 0.50
▸ MMP9 P14780 1/20 0.46
▸ MMP8 P22894 1/20 0.46
▸ SMN1; SMN2 Q16637 5/20 0.46
▸ TP53 P04637 3/20 0.46
▸ HPGD P15428 4/20 0.43

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
SCHEMBL21794477 0.75 APP (0.57) APPMAPTGAAKDM4ENPC1
SCHEMBL6494589 0.74 MAPT (0.72) APPMAPTGAAKDM4ENPC1
SCHEMBL8393309 0.71 APP (0.73) APPMAPTGAAKDM4ENPC1
SCHEMBL11749470 0.71 MAPT (0.64) APPMAPTGAAKDM4ENPC1
SCHEMBL15496408 0.70 MAPT (0.79) APPMAPTGAAKDM4ENPC1
SCHEMBL4593965 0.69 APP (0.94) APPMAPTGAAKDM4ENPC1
SCHEMBL4604185 0.69 MAPT (0.76) APPMAPTGAAKDM4ENPC1
SCHEMBL15510887 0.68 MAPT (0.77) APPMAPTGAAKDM4ENPC1
SCHEMBL27774016 0.68 APP (0.60) APPMAPTGAAKDM4ENPC1
SCHEMBL6399498 0.67 MAPT (1.00) APPMAPTGAAKDM4ENPC1

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-4024125-A Dis-azo pigments deriving from bis-diazotized diamino-2-phenyl-benzazolones HOECHST AKTIENGESELLSCHAFT (DT) 1977-05-17 — — US disclosed
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