SCHEMBL3439274

SCHEMBL3439274

COc1ccc(-c2ccc(Oc3ccccc3S(=O)(=O)O)c(S(=O)(=O)O)c2)cc1S(=O)(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 1/20 0.45
▸ ACLY P53396 4/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ BRD4 O60885 3/20 0.41
▸ ALPL P05186 1/20 0.41
▸ GSK3B P49841 1/20 0.40
▸ WDR5 P61964 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ TRIM24 O15164 1/20 0.39
▸ BRD2 P25440 1/20 0.39
▸ BRD3 Q15059 1/20 0.39
▸ MPL P40238 1/20 0.39

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
SCHEMBL13297310 0.87 GSK3B (0.48) ACLYKMT2AALDH1A1LMNAMAPT
SCHEMBL286480 0.83 HTR6 (0.60) HTR6KMT2AALDH1A1LMNAMAPT
SCHEMBL29822548 0.83 HTR6 (0.60) HTR6KMT2AALDH1A1LMNAMAPT
SCHEMBL12455724 0.82 TSHR (0.39) HTR6ACLYKMT2AALDH1A1LMNA
SCHEMBL11357074 0.82 HTR6 (0.58) HTR6KMT2AALDH1A1LMNAMAPT
Hydrochloric Acid SCHEMBL11757968 0.82 HTR6 (0.58) HTR6KMT2AALDH1A1LMNAMAPT
SCHEMBL417961 0.82 HTR6 (0.58) HTR6KMT2AALDH1A1LMNAMAPT
Ammonia Solution, Strong SCHEMBL8436847 0.82 HTR6 (0.58) HTR6KMT2AALDH1A1LMNAMAPT
Water SCHEMBL8627344 0.82 HTR6 (0.58) HTR6KMT2AALDH1A1LMNAMAPT
Ammonia Solution, Strong SCHEMBL30384956 0.82 HTR6 (0.58) HTR6KMT2AALDH1A1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2362472-B1 Production method for polymer electrolyte UBE INDUSTRIES (JP) 2012-10-24 — — EP disclosed
EP-2355218-B1 Novel polymer electrolyte, polymer electrolyte composition, electrolyte membrane, and production method and use thereof UBE INDUSTRIES (JP) 2012-10-03 — — EP disclosed
EP-1855339-B1 NOVEL POLYMER ELECTROLYTE, POLYMER ELECTROLYTE COMPOSITION, ELECTROLYTE MEMBRANE, AND PRODUCTION METHOD AND USE THEREOF UBE INDUSTRIES (JP) 2012-01-04 — — EP disclosed
EP-2355218-A1 Novel polymer electrolyte, polymer electrolyte composition, electrolyte membrane, and production method and use thereof Ube Industries, Ltd. (JP) 2011-08-10 — — EP disclosed
EP-1855339-A1 NOVEL POLYMER ELECTROLYTE, POLYMER ELECTROLYTE COMPOSITION, ELECTROLYTE MEMBRANE, AND PRODUCTION METHOD AND USE THEREOF Ube Industries, Ltd. (JP) 2007-11-14 — — EP disclosed
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