SCHEMBL3396632

SCHEMBL3396632

[CH2]OS(=O)(=O)c1ccccc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
ESR1 P03372 2/20 0.46
ESR2 Q92731 2/20 0.46
GAA P10253 1/20 0.46
POLB P06746 1/20 0.45
ALDH1A1 P00352 7/20 0.44
ATM Q13315 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
HTR6 P50406 1/20 0.39
RAPGEF4 Q8WZA2 1/20 0.39
KDM4E B2RXH2 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
TP53 P04637 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
TSHR P16473 1/20 0.38
ACHE P22303 1/20 0.38
MCOLN3 Q8TDD5 1/20 0.37

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
SCHEMBL31515627 0.82 KMT2A (0.49) KMT2AMEN1ESR1ESR2GAA
SCHEMBL9803 0.82 KMT2A (0.49) KMT2AMEN1ESR1ESR2GAA
SCHEMBL31244372 0.80 MEN1 (0.47) KMT2AMEN1ESR1ESR2GAA
SCHEMBL8019502 0.80 KMT2A (0.47) KMT2AMEN1ESR1ESR2GAA
SCHEMBL260819 0.80 MEN1 (0.47) KMT2AMEN1ESR1ESR2GAA
SCHEMBL7999641 0.78 KMT2A (0.46) KMT2AMEN1ESR1ESR2GAA
SCHEMBL28537450 0.78 KMT2A (0.46) KMT2AMEN1ESR1ESR2GAA
SCHEMBL29574672 0.78 MEN1 (0.46) KMT2AMEN1ESR1ESR2GAA
SCHEMBL8984873 0.78 KMT2A (0.51) KMT2AMEN1ESR1ESR2GAA
SCHEMBL8105501 0.78 KMT2A (0.46) KMT2AMEN1ESR1ESR2GAA

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105732334-B Process for producing olefin derivative composition DIC株式会社 2021-07-06 CN claimed
EP-2203519-A1 SULFONATE ESTERS AS LATENT ACID CATALYSTS King Industries (US) 2010-07-07 EP claimed
WO-2009045466-A1 SULFONATE ESTERS AS LATENT ACID CATALYSTS KING INDUSTRIES (US) 2009-04-09 WO claimed
EP-0112603-B1 APHIDICOLANE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-03-04 EP claimed
EP-0112603-A1 Aphidicolane derivatives, their preparation and pharmaceutical compositions comprising them IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-07-04 EP claimed
CN-105732334-B Process for producing olefin derivative composition DIC株式会社 2021-07-06 CN disclosed
EP-2012799-A2 METABOLICALLY STABLE ALKOXYALKYL ESTERS OF ANTIVIRAL OR ANTIPROLIFERATIVE PHOSPHONATES, NUCLEOSIDE PHOSPHONATES AND NUCLEOSIDE PHOSPHATES Chimerix, Inc. (US) 2009-01-14 EP disclosed
EP-1902717-A2 Vasopressin antagonist and oxytocin antagonist Otsuka Pharmaceutical Company, Limited (JP) 2008-03-26 EP disclosed
EP-0620003-B1 VASOPRESSIN ANTAGONIST AND OXYTOCIN ANTAGONIST OTSUKA PHARMA CO LTD (JP) 2008-01-16 EP disclosed
WO-2007130783-A2 METABOLICALLY STABLE ALKOXYALKYL ESTERS OF ANTIVIRAL OR ANTIPROLIFERATIVE PHOSPHONATES, NUCLEOSIDE PHOSPHONATES AND NUCLEOSIDE PHOSPHATES CHIMERIX, INC. (US) 2007-11-15 WO disclosed
WO-2006099884-A1 BETA-AMINOALCOHOL ANTIBIOTICS ACTELION PERCUREX AG (CH) 2006-09-28 WO disclosed
US-5753644-A Vasopressin antagonist and oxytocin antagonist OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-05-19 US disclosed
US-4853149-A STABILITY MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1989-08-01 US disclosed
EP-0323867-A1 Novel HMG-COA reductase inhibitors MERCK & CO. INC. (US) 1989-07-12 EP disclosed
US-4803201-A Homocyclic derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1989-02-07 US disclosed
EP-0112603-B1 APHIDICOLANE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-03-04 EP disclosed
EP-0112603-A1 Aphidicolane derivatives, their preparation and pharmaceutical compositions comprising them IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-07-04 EP disclosed
US-4212976-A ANTIARTHRITIC AGENTS MERCK & CO., INC. (US) 1980-07-15 US disclosed
US-4057637-A RHEUMATOID ARTHRITIS MERCK & CO., INC. (US) 1977-11-08 US disclosed
US-3971797-A ANTIARTHRITIC MERCK & CO., INC. (US) 1976-07-27 US disclosed