SCHEMBL8769004

SCHEMBL8769004

CCCOc1ccc(-c2nc(SC)nc(-c3ccc(OCCC)cc3O)n2)c(O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 5/20 0.51
▸ MAPT P10636 6/20 0.44
▸ LMNA P02545 4/20 0.44
▸ HTT P42858 3/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ ATM Q13315 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ LTA4H P09960 1/20 0.43
▸ SMN1; SMN2 Q16637 4/20 0.42
▸ L3MBTL1 Q9Y468 3/20 0.42
▸ KMT2A Q03164 4/20 0.42
▸ NPC1 O15118 3/20 0.42
▸ MEN1 O00255 3/20 0.42
▸ RAB9A P51151 3/20 0.42
▸ GAA P10253 1/20 0.42
▸ ADORA3 P0DMS8 2/20 0.40
▸ ADORA2A P29274 2/20 0.40
▸ ACACB O00763 1/20 0.39
▸ ACACA Q13085 1/20 0.39
▸ HPGD P15428 1/20 0.38

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
SCHEMBL14814841 0.90 LTA4H (0.51) MAPK1MAPTLMNAHTTALDH1A1
SCHEMBL29502776 0.90 LTA4H (0.51) MAPK1MAPTLMNAHTTALDH1A1
SCHEMBL8769121 0.89 MAPK1 (0.54) MAPK1MAPTLMNAHTTALDH1A1
SCHEMBL8929322 0.88 MAPT (0.46) MAPK1MAPTLMNAHTTALDH1A1
SCHEMBL8928588 0.86 NPC1 (0.46) MAPK1MAPTLMNAHTTALDH1A1
SCHEMBL13021253 0.84 NPC1 (0.56) MAPTLMNAHTTALDH1A1ATM
SCHEMBL14813417 0.81 MAPT (0.44) MAPK1MAPTLMNAHTTALDH1A1
SCHEMBL29502785 0.81 MAPT (0.44) MAPK1MAPTLMNAHTTALDH1A1
SCHEMBL30174369 0.81 NPC1 (0.62) MAPK1MAPTHTTALDH1A1TDP1
SCHEMBL8767871 0.81 NPC1 (0.62) MAPK1MAPTHTTALDH1A1TDP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5649980-A Process for the photochemical and thermal stabilization of undyed and dyed polyester fibre materials CIBA-GEIGY CORPORATION (US) 1997-07-22 — — US disclosed
EP-0584044-B1 Process for photochemical and thermal stabilization of undyed and dyed polyester fibrous materials CIBA GEIGY AG (CH) 1997-07-16 — — EP disclosed
EP-0584044-A1 Process for photochemical and thermal stabilization of undyert and dyert polyester fibrous materials CIBA-GEIGY AG (CH) 1994-02-23 — — EP disclosed
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