SCHEMBL4564629

SCHEMBL4564629

O=S(=O)(O)C1C=Cc2cccc3cccc1c23

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31
CES2 O00748 1/20 0.31
ALDH1A1 P00352 1/20 0.31
BCHE P06276 1/20 0.31
CES1 P23141 1/20 0.31
MCL1 Q07820 1/20 0.31

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
Hydrochloric Acid SCHEMBL27785413 0.98 MEN1 (0.30) MEN1MAPTMAPK1KMT2A
Phosphonic Acid SCHEMBL27803491 0.94
Phosphoric Acid SCHEMBL27661049 0.89
Methacrylic Acid SCHEMBL27709349 0.88 KDM4E (0.31) KMT2AALDH1A1
SCHEMBL28768752 0.87
SCHEMBL27579326 0.86 MEN1 (0.33) MEN1MAPTMAPK1KMT2ACES2
SCHEMBL27951815 0.83 MEN1 (0.31) MEN1MAPTMAPK1KMT2ACES2
SCHEMBL5173651 0.83
SCHEMBL27689679 0.83 TBXA2R (0.30)
SCHEMBL5709695 0.82 MEN1 (0.30) MEN1MAPTMAPK1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107353645-B Polyphenylene sulfide self-lubricating resin composition easy to crystallize and preparation method thereof 四川大学 2020-01-10 CN disclosed
CN-104011124-A NUCLEATING SYSTEM FOR POLYARYLENE SULFIDE COMPOSITIONS TICONA LLC 2014-08-27 CN disclosed
US-20090259013-A1 LIQUID CRYSTAL POLY(PHENYLENE DISULFONIC ACIDS) CASE WESTERN RESERVE UNIVERSITY 2009-10-15 US disclosed
US-7375176-B2 Liquid crystal poly(phenylene sulfonic acids) CASE WESTERN RESERVE UNIVERSITY 2008-05-20 US disclosed
US-20050239994-A1 Liquid crystal poly(phenylene sulfonic acids) CASE WESTERN RESERVE UNIVERSITY 2005-10-27 US disclosed
CN-1113692-C Modified carbon adsorbents and process for adsorption CABOT CORP (US) 2003-07-09 CN disclosed
CN-1227509-A Modified carbon adsorbents and process for adsorption CABOT CORP (US) 1999-09-01 CN disclosed
US-4069218-A COTTON CIBA-GEIGY CORPORATION (US) 1978-01-17 US disclosed
US-4033943-A Fiber reactive water soluble 2,4,6-triamino, 3-cyano pyridine-(5) azo dyestuffs CIBA-GEIGY CORPORATION (US) 1977-07-05 US disclosed