SCHEMBL8393309

SCHEMBL8393309

Nc1ccc(-c2nc3cc(O)cc(O)c3s2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 12/20 0.73
▸ MAPT P10636 7/20 0.55
▸ GAA P10253 6/20 0.55
▸ KDM4E B2RXH2 5/20 0.55
▸ NPC1 O15118 5/20 0.55
▸ RAB9A P51151 5/20 0.55
▸ ALDH1A1 P00352 4/20 0.55
▸ POLB P06746 2/20 0.55
▸ NFKB1 P19838 2/20 0.55
▸ GFER P55789 2/20 0.55
▸ NFKB2 Q00653 2/20 0.55
▸ RELA Q04206 2/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ TP53 P04637 3/20 0.54
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ THRB P10828 1/20 0.54
▸ GLA P06280 4/20 0.51
▸ MMP9 P14780 1/20 0.51
▸ MMP8 P22894 1/20 0.51

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
SCHEMBL13391563 0.79 APP (0.77) APPMAPTGAAKDM4ENPC1
SCHEMBL14568989 0.74 GAA (0.58) APPMAPTGAAKDM4ENPC1
SCHEMBL10032124 0.74 APP (0.52) APPMAPTGAAKDM4ENPC1
SCHEMBL2036269 0.73 APP (1.00) APPMAPTGAAKDM4ENPC1
SCHEMBL12421911 0.73 APP (0.66) APPMAPTGAAKDM4ENPC1
SCHEMBL27774016 0.72 APP (0.60) APPMAPTGAAKDM4ENPC1
SCHEMBL6399498 0.71 MAPT (1.00) APPMAPTGAAKDM4ENPC1
SCHEMBL29918176 0.71 MAPT (1.00) APPMAPTGAAKDM4ENPC1
SCHEMBL11753243 0.71 APP (0.50) APPMAPTGAAKDM4ENPC1
SCHEMBL15496408 0.71 MAPT (0.79) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0721336-B1 BENZAZOLE COMPOUNDS FOR USE IN THERAPY CANCER RES CAMPAIGN TECH (GB) 1999-07-14 — — EP disclosed
US-5874431-A ANTITUMOR AGENTS; BREAST CANCER CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 1999-02-23 — — US disclosed
EP-0721336-A1 BENZAZOLE COMPOUNDS FOR USE IN THERAPY CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 1996-07-17 — — EP disclosed
WO-1995006469-A1 BENZAZOLE COMPOUNDS FOR USE IN THERAPY CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 1995-03-09 — — WO disclosed
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