SCHEMBL11515558

SCHEMBL11515558

Cc1ccc2c(c1)sc(C)[n+]2C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 11/20 0.58
▸ KDM4E B2RXH2 6/20 0.58
▸ LMNA P02545 1/20 0.58
▸ APP P05067 2/20 0.53
▸ SNCA P37840 2/20 0.53
▸ TNF P01375 1/20 0.53
▸ NOD1 Q9Y239 1/20 0.53
▸ POLB P06746 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ BCHE P06276 1/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ NPC1 O15118 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ INSR P06213 3/20 0.48
▸ ALDH1A1 P00352 4/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ GAA P10253 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ HPGD P15428 1/20 0.39
▸ PARP10 Q53GL7 2/20 0.36

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
Iodide SCHEMBL31063723 0.98 MAPT (0.61) MAPTKDM4ELMNAAPPSNCA
SCHEMBL14434817 0.83 MAPT (0.61) MAPTKDM4ELMNAAPPSNCA
Iodide SCHEMBL31063683 0.82 MAPT (0.64) MAPTKDM4ELMNAAPPSNCA
SCHEMBL29685190 0.80 APP (0.50) MAPTKDM4ELMNAAPPSNCA
SCHEMBL11516326 0.80 MAPT (0.45) MAPTKDM4ELMNAAPPSNCA
SCHEMBL9031987 0.80 APP (0.50) MAPTKDM4ELMNAAPPSNCA
Iodide SCHEMBL31063860 0.79 MAPT (0.47) MAPTKDM4ELMNAAPPSNCA
SCHEMBL6658511 0.77 KDM4E (0.42) MAPTKDM4ELMNAAPPSNCA
SCHEMBL13652077 0.77 MAPT (0.73) MAPTKDM4ELMNASNCAPOLB
SCHEMBL11516456 0.77 APP (0.55) MAPTKDM4ELMNAAPPSNCA

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-4145537-A BENZOTHIAZOLIUM DYES BAYER AKTIENGESELLSCHAFT (DE) 1979-03-20 — — US disclosed
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