SCHEMBL599953

SCHEMBL599953

Cc1cc(C)c(-c2ccccc2S(=O)(=O)O)c(C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGAM1 P18669 1/20 0.46
MYC P01106 1/20 0.42
TTR P02766 2/20 0.41
ALDH1A1 P00352 4/20 0.40
L3MBTL1 Q9Y468 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MAPT P10636 3/20 0.40
NSD2 O96028 3/20 0.40
POLB P06746 2/20 0.40
THRB P10828 2/20 0.40
HPGD P15428 2/20 0.40
MAPK1 P28482 2/20 0.40
RECQL P46063 2/20 0.40
P2RY1 P47900 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
ELANE P08246 2/20 0.40
PDK2 Q15119 1/20 0.40

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
SCHEMBL7193932 0.87 FFAR4 (0.44) PGAM1ALDH1A1L3MBTL1SMN1; SMN2MEN1
SCHEMBL1501182 0.82 MEN1 (0.40) TTRALDH1A1L3MBTL1SMN1; SMN2MEN1
SCHEMBL28927247 0.82 SMN1; SMN2 (0.40) TTRALDH1A1L3MBTL1SMN1; SMN2MEN1
SCHEMBL2761135 0.81 ELANE (0.47) PGAM1MYCALDH1A1MEN1KMT2A
SCHEMBL27627996 0.80 MYC (0.43) PGAM1MYCTTRALDH1A1L3MBTL1
SCHEMBL28436123 0.80 GNG2 (0.52) PGAM1ALDH1A1L3MBTL1SMN1; SMN2MEN1
SCHEMBL25250572 0.77 PGAM1 (0.41) PGAM1MYCTTRALDH1A1L3MBTL1
SCHEMBL5674095 0.77 ELANE (0.47) PGAM1MYCALDH1A1MEN1KMT2A
SCHEMBL3886759 0.77 MYC (0.47) PGAM1MYCTTRSMN1; SMN2HPGD
SCHEMBL7782769 0.77 CA1 (0.42) ALDH1A1L3MBTL1MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030144244-A1 Stable compositions of S-adenosyl-l-methionine with dextran HEBERT SAM-E LLC 2003-07-31 US claimed
US-20020025926-A1 Enantiomers of S-adenosyl-l-methionine HEBERT ROLLAND F (US) 2002-02-28 US claimed
US-4057686-A Sulphonic acid salts of S-adenosilmethionine BIORESEARCH LIMITED (IT) 1977-11-08 US claimed
EP-2945959-B1 STABLE INDOLE-3-PROPIONATE SALTS OF S-ADENOSYL-L-METHIONINE HEBERT SAM E LLC (US) 2020-05-13 EP disclosed
CN-105073767-B The propionate of indoles 3 of stable S adenosine L methionine 赫伯特·山姆-E有限责任公司 2018-01-02 CN disclosed
US-9534010-B2 Stable indole-3-propionate salts of S-adenosyl-L-methionine HEBERT SAM-E LLC 2017-01-03 US disclosed
US-20150344517-A1 STABLE INDOLE-3-PROPIONATE SALTS OF S-ADENOSYL-L-METHIONINE HEBERT SAM-E LLC 2015-12-03 US disclosed
EP-2945959-A1 STABLE INDOLE-3-PROPIONATE SALTS OF S-ADENOSYL-L-METHIONINE Hebert Sam-E LLC (US) 2015-11-25 EP disclosed
CN-105073767-A Stable indole-3-propionate salts of S-adenosyl-L-methionine HEBERT SAM E LLC 2015-11-18 CN disclosed
WO-2014113609-A1 STABLE INDOLE-3-PROPIONATE SALTS OF S-ADENOSYL-L-METHIONINE HEBERT SAM-E LLC (US) 2014-07-24 WO disclosed
US-20120040923-A1 STABLE S-ADENOSYL-L-METHIONINE HEBERT ROLLAND F (US) 2012-02-16 US disclosed
US-20090012036-A1 Stable S-adenosyl-L-methionine HEBERT SAM-E LLC 2009-01-08 US disclosed
US-20050272687-A1 Stable S-adenosyl-l-methionine HEBERT ROLLAND F 2005-12-08 US disclosed
US-20040063660-A1 Diasteriomers of S-adenosyl-l-methionine and uses thereof HEBERT ROLLAND F (US) 2004-04-01 US disclosed
EP-0108817-A1 Stable composition of S-adenosyl-L-methionine and process for preparation thereof Kanegafuchi Chemical Industry Co., Ltd. (JP) 1984-05-23 EP disclosed
US-4242505-A S-Adenosyl-L-methionine compositions and production thereof YAMASA SHOYU KABUSHIKI KAISHA (JP) 1980-12-30 US disclosed