SCHEMBL27361835

SCHEMBL27361835

CCCCN(C)C(=S)S.[Cu]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
ALDH2 P05091 1/20 0.46
CA12 O43570 6/20 0.39
CA1 P00915 6/20 0.39
CA9 Q16790 6/20 0.39
CA2 P00918 4/20 0.39
HTT P42858 2/20 0.39
ABCB11 O95342 1/20 0.39
CYP2E1 P05181 1/20 0.39
PTGS1 P23219 1/20 0.39
GSDMD P57764 1/20 0.39
MGLL Q99685 1/20 0.36
MAPT P10636 2/20 0.35
DNM1 Q05193 3/20 0.33
TDP1 Q9NUW8 1/20 0.33
EPHX2 P34913 1/20 0.33
CYP1A2 P05177 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL1286291 0.98
SCHEMBL28815406 0.95 ALDH1A1 (0.46) ALDH1A1ALDH2CA12CA1CA9
SCHEMBL27992382 0.95 ALDH1A1 (0.46) ALDH1A1ALDH2CA12CA1CA9
SCHEMBL27362722 0.93 MGLL (0.44) ALDH1A1ALDH2CA12CA1CA9
SCHEMBL27389399 0.91 MGLL (0.47) ALDH1A1ALDH2CA12CA1CA9
SCHEMBL1285962 0.91 MGLL (0.45) ALDH1A1ALDH2CA12CA1CA9
SCHEMBL23388550 0.88 MGLL (0.48) ALDH1A1ALDH2CA12CA1CA9
SCHEMBL30700012 0.88 MGLL (0.48) ALDH1A1ALDH2CA12CA1CA9
SCHEMBL1285949 0.88 MGLL (0.48) ALDH1A1ALDH2CA12CA1CA9
SCHEMBL28592560 0.86 MGLL (0.43) ALDH1A1ALDH2CA12CA1CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103237782-B Method for inhibiting unwanted free-radical polymerization of acrylic acid present in liquid phase P BASF SE (DE) 2016-01-13 CN disclosed
CN-103237782-A Method for inhibiting unwanted free-radical polymerization of acrylic acid present in liquid phase P BASF SE 2013-08-07 CN disclosed
CN-101679199-B Method for distilling liquid containing easily polymerizable compound NIPPON CATALYTIC CHEM IND 2013-05-29 CN disclosed
CN-1472187-B Method for producing acrylic acid NIPPON CATALYTIC CHEM IND 2010-12-15 CN disclosed
CN-101679199-A Method for distilling liquid containing easily polymerizable compound NIPPON CATALYTIC CHEM IND 2010-03-24 CN disclosed
CN-100516006-C Method for producing easily polymerizable substance NIPPON CATALYTIC CHEM IND (JP) 2009-07-22 CN disclosed
CN-100341841-C Method for producing acrylic acid NIPPON CATALYTIC CHEM IND (JP) 2007-10-10 CN disclosed
CN-1250510-C Process for decomposing Michael type adduct NIPPON CATALYTIC CHEM IND (JP) 2006-04-12 CN disclosed
CN-1217911-C Method for preventing easily polymerizable substance from polymerization and method for producing acrylic acid or ester thereof NIPPON CATALYTIC CHEM IND (JP) 2005-09-07 CN disclosed
CN-1550480-A Method for producing easily polymerizable substance 株式会社日本触媒 2004-12-01 CN disclosed
CN-1480441-A Process for producing acroleic acid ��ʽ�����ձ���ý 2004-03-10 CN disclosed
CN-1480442-A Method for producing acrylic acid ��ʽ�����ձ���ý 2004-03-10 CN disclosed
CN-1472187-A Method for producing acrylic acid ��ʽ�����ձ���ý 2004-02-04 CN disclosed
CN-1453260-A Process for decomposing Michael type adduct NIPPON CATALYTIC CHEM IND (JP) 2003-11-05 CN disclosed
CN-1389448-A Method for preventing easily polymerizable substance from polymerizing and method for producing acrylic acid or ester thereof NIPPON CATALYTIC CHEM IND (JP) 2003-01-08 CN disclosed
CN-1083410-C Method for inhibiting polymerization of vinyl compounds IDEMITSU PETROCHEMICAL CO (JP) 2002-04-24 CN disclosed
CN-1069305-C Method of inhibiting vinyl compound polymerization IDEMITSU PETROCHEMICAL CO (JP) 2001-08-08 CN disclosed
CN-1198730-A Method for inhibiting polymerization of vinyl compounds IDEMITSU PETROCHEMICAL CO (JP) 1998-11-11 CN disclosed
CN-1157606-A Method of inhibiting vinyl compound polymerization IDEMITSU PETROCHEMICAL CO (JP) 1997-08-20 CN disclosed