SCHEMBL3901779

SCHEMBL3901779

CCCCCCc1ccccc1NC([O-])=S.NC([O-])=S.[Cu+2]

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ LMNA P02545 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ SLC16A3 O15427 4/20 0.40
▸ POLB P06746 1/20 0.40
▸ CYSLTR2 Q9NS75 3/20 0.39
▸ CYSLTR1 Q9Y271 3/20 0.39
▸ SCD O00767 2/20 0.37
▸ BID P55957 2/20 0.37
▸ BCL2L1 Q07817 2/20 0.37
▸ MCL1 Q07820 2/20 0.37
▸ BAK1 Q16611 2/20 0.37
▸ GRIN2D O15399 1/20 0.37
▸ GRIN3B O60391 1/20 0.37
▸ GRIN1 Q05586 1/20 0.37
▸ GRIN2A Q12879 1/20 0.37
▸ GRIN2B Q13224 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
SCHEMBL4612130 0.99 ALDH1A1 (0.43) LIPGALDH1A1GAAMAPTLMNA
SCHEMBL3925470 0.97 LIPG (0.45) LIPGALDH1A1GAAMAPTLMNA
SCHEMBL4615000 0.94 ALDH1A1 (0.44) LIPGALDH1A1GAAMAPTLMNA
Zinc Ion SCHEMBL137278 0.92 ALDH1A1 (0.44) LIPGALDH1A1GAAMAPTLMNA
SCHEMBL4614973 0.88 ALDH1A1 (0.46) ALDH1A1GAAMAPTLMNAHTT
Zinc Ion SCHEMBL940630 0.85 LIPG (0.39) LIPGALDH1A1GAAMAPTCYSLTR2
Zinc Ion SCHEMBL940453 0.85 LIPG (0.39) LIPGALDH1A1GAAMAPTCYSLTR2
Zinc Ion SCHEMBL940134 0.85 LIPG (0.39) LIPGALDH1A1GAAMAPTCYSLTR2
Zinc Ion SCHEMBL8382881 0.85 LIPG (0.39) LIPGALDH1A1GAAMAPTCYSLTR2
Zinc Ion SCHEMBL8380066 0.85 LIPG (0.39) LIPGALDH1A1GAAMAPTCYSLTR2

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
EP-1382592-B1 Method for production of acrylic acid NIPPON CATALYTIC CHEM IND (JP) 2009-01-28 — — EP disclosed
EP-1388532-B1 Method for production of acrylic acid NIPPON CATALYTIC CHEM IND (JP) 2008-06-18 — — EP disclosed
EP-1388533-B1 Method for production of acrylic acid NIPPON CATALYTIC CHEM IND (JP) 2008-06-18 — — EP disclosed
EP-1357105-B1 Decomposition of a Michael type adduct of acrylic acid or acrylic acid ester NIPPON CATALYTIC CHEM IND (JP) 2008-03-12 — — EP disclosed
US-7332624-B2 Method for production of acrylic acid NIPPON SHOKUBAI CO., LTD. (JP) 2008-02-19 — — US disclosed
US-7304176-B2 Process for producing easily polymerizable substance NIPPON SHOKUBAI CO., LTD. (JP) 2007-12-04 — — US disclosed
US-7109372-B2 Method for production of acrylic acid NIPPON SHOKUBAI CO., LTD (JP) 2006-09-19 — — US disclosed
US-7038079-B2 Method for production of acrylic acid NIPPON SHOKUBAI CO., LTD. (JP) 2006-05-02 — — US disclosed
EP-1264819-B1 Process for inhibiting polymerization of a vinyl compound IDEMITSU KOSAN CO (JP) 2005-05-18 — — EP disclosed
US-6870066-B2 Method for decomposition of Michael type adduct NIPPON SHOKUBAI CO., LTD (JP) 2005-03-22 — — US disclosed
EP-1264819-A1 Process for inhibiting polymerization of a vinyl compound IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2002-12-11 — — EP disclosed
US-6476162-B1 Method for preventing easily polymerizing substance from polymerization and method for production of (meth) acrylic acid or ester thereof NIPPON SHOKUBAI CO., LTD. (JP) 2002-11-05 — — US disclosed
US-20020002253-A1 Method for preventing polymerization of (meth) acrylic acid and esters thereof and method for the production thereof NIPPON SHOKUBAI CO., LTD. (JP) 2002-01-03 — — US disclosed
EP-1162192-A2 Method for preventing polymerization of olefinic monomers and method for the production thereof Nippon Shokubai Co., Ltd. (JP) 2001-12-12 — — EP disclosed
EP-1043303-A1 Method of inhibiting vinyl compound polymerization Idemitsu Petrochemical Co., Ltd. (JP) 2000-10-11 — — EP disclosed
US-6051735-A ALLOWING CORROSION INHIBITOR SELECTED FROM: ALIPHATIC ALCOHOL, INORGANIC ACID OR SALT, AROMATIC CARBOXYLIC ACID OR SALT AND ZINC-CONTAINING SALT TO COEXIST WITH METALLIC SALT OF DITHIOCARBAMIC ACID DURING PRODUCTION ACRYLIC ACID IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2000-04-18 — — US disclosed
US-5886220-A INCORPORATING WATER AND METALLIC SALT OF DITHIOCARBAMIC ACID AS A POLYMERIZATION INHIBITOR IN PRODUCTION OF ACRYLIC OR MATHACRYLIC OR OTHER VINYL COMPOUNDS IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1999-03-23 — — US disclosed
US-5856568-A USING MIXTURE OF N-NITROSOPHENYLHYDROXYLAMINE; COPPER COMPOUND AND ACID IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1999-01-05 — — US disclosed
EP-0855376-A1 METHOD FOR INHIBITING POLYMERIZATION OF VINYL COMPOUNDS IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1998-07-29 — — EP disclosed
EP-0781755-A1 METHOD OF INHIBITING VINYL COMPOUND POLYMERIZATION IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1997-07-02 — — EP disclosed
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