SCHEMBL3925470

SCHEMBL3925470

CCCCCCCc1ccccc1NC([O-])=S.NC([O-])=S.[Ba+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
SCHEMBL3901779 0.97 LIPG (0.45) LIPGALDH1A1GAAMAPTLMNA
SCHEMBL4612130 0.96 ALDH1A1 (0.43) LIPGALDH1A1GAAMAPTLMNA
SCHEMBL4615000 0.92 ALDH1A1 (0.44) LIPGALDH1A1GAAMAPTLMNA
Zinc Ion SCHEMBL137278 0.92 ALDH1A1 (0.44) LIPGALDH1A1GAAMAPTLMNA
SCHEMBL4614973 0.85 ALDH1A1 (0.46) ALDH1A1GAAMAPTLMNAHTT
Zinc Ion SCHEMBL940630 0.85 LIPG (0.39) LIPGALDH1A1GAAMAPTCYSLTR2
Zinc Ion SCHEMBL942913 0.85 LIPG (0.39) LIPGALDH1A1GAAMAPTCYSLTR2
Zinc Ion SCHEMBL940134 0.85 LIPG (0.39) LIPGALDH1A1GAAMAPTCYSLTR2
Zinc Ion SCHEMBL8380066 0.85 LIPG (0.39) LIPGALDH1A1GAAMAPTCYSLTR2
Zinc Ion SCHEMBL941750 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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115605374-A Condition monitoring of heat transfer fluids for electrical systems 埃克森美孚技术与工程公司(US) 2023-01-13 — — CN disclosed
US-9126924-B2 Chemical composition THE CHARLES STARK DRAPER LABORATORY, INC. (US) 2015-09-08 — — US disclosed
US-9062272-B2 Lubricant composition and methods of using same THE CHARLES STARK DRAPER LABORATORY, INC. (US) 2015-06-23 — — US disclosed
US-20130331589-A1 CHEMICAL COMPOSITION THE CHARLES STARK DRAPER LABORATORY, INC. (US) 2013-12-12 — — US disclosed
US-20130327594-A1 LUBRICANT COMPOSITION AND METHODS OF USING SAME THE CHARLES STARK DRAPER LABORATORY, INC. (US) 2013-12-12 — — US disclosed
EP-0825246-B1 Lubricants and functional fluids containing heterocyclic compounds LUBRIZOL CORP (US) 2009-04-01 — — EP disclosed
EP-0764715-B1 Additive compositions for lubricants and functional fluids LUBRIZOL CORP (US) 2002-05-29 — — EP disclosed
EP-0157969-B2 Organo-borate compositions and their use in lubricants LUBRIZOL CORP (US) 2000-01-12 — — EP disclosed
EP-0869165-A2 Mixed polysulfides and lubricants and functional fluids containing the same The Lubrizol Corporation (US) 1998-10-07 — — EP disclosed
EP-0825247-A2 Compositions containing thiocarbonates and acylated-nitrogen containing compounds The Lubrizol Corporation (US) 1998-02-25 — — EP disclosed
EP-0285609-B1 GRAFT COPOLYMERS PREPARED FROM SOLVENT-FREE REACTIONS AND DISPERSANT DERIVATIVES THEREOF LUBRIZOL CORP (US) 1994-02-09 — — EP disclosed
EP-0287569-B1 OIL-SOLUBLE REACTION PRODUCTS OF AN ACYLATED REACTION PRODUCT, A POLYAMINE, AND A MONO-FUNCTIONAL ACID LUBRIZOL CORP (US) 1994-02-02 — — EP disclosed
US-5143634-A Benzotriazole and Derivatives AMOCO CORPORATION (US) 1992-09-01 — — US disclosed
EP-0242405-B1 SULFIDOXYMOLYBDENUM DIALKYLPHOSPHORODITHIOATE ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1989-12-13 — — EP disclosed
US-4789492-A LUBRICANT ADDITIVE ASAHI DENKA KOGYO K.K. (JP) 1988-12-06 — — US disclosed
EP-0287569-A1 OIL-SOLUBLE REACTION PRODUCTS OF AN ACYLATED REACTION PRODUCT, A POLYAMINE, AND A MONO-FUNCTIONAL ACID. LUBRIZOL CORP (US) 1988-10-26 — — EP disclosed
EP-0242405-A1 Sulfidoxymolybdenum dialkylphosphorodithioate ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1987-10-28 — — EP disclosed
WO-1987003897-A1 OIL-SOLUBLE REACTION PRODUCTS OF AN ACYLATED REACTION PRODUCT, A POLYAMINE, AND A MONO-FUNCTIONAL ACID THE LUBRIZOL CORPORATION (US) 1987-07-02 — — WO disclosed
US-4670173-A DISPERSANTS; VISCOSITY IMPROVERS; GEL-FREE THE LUBRIZOL CORPORATION (US) 1987-06-02 — — US disclosed
EP-0157969-A1 Organo-borate compositions and their use in lubricants The Lubrizol Corporation (US) 1985-10-16 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130331589-A1 CHEMICAL COMPOSITION VCL, SDC2, MUC1 LIPG 1247/4885ALDH1A1 1076/4885GAA 4114/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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