SCHEMBL3226399

SCHEMBL3226399

CCCCCCCCCCOC(N)=S.CCCCCCCCCCOC(N)=S

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.59
CA1 P00915 3/20 0.59
CA2 P00918 3/20 0.59
CA9 Q16790 3/20 0.59
NAAA Q02083 1/20 0.50
EPHX1 P07099 1/20 0.47
TSHR P16473 2/20 0.45
LPAR2 Q9HBW0 3/20 0.45
LPAR3 Q9UBY5 3/20 0.45
HTR2C P28335 1/20 0.44
PRSS1 P07477 1/20 0.43
PRSS2 P07478 1/20 0.43
PRSS3 P35030 1/20 0.43
HCAR2 Q8TDS4 1/20 0.42
RAD52 P43351 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MAPT P10636 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
ALDH1A1 P00352 1/20 0.42

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
SCHEMBL28040240 1.00 CA12 (0.59) CA12CA1CA2CA9NAAA
SCHEMBL14763657 1.00 CA12 (0.59) CA12CA1CA2CA9NAAA
SCHEMBL9648929 1.00 CA12 (0.59) CA12CA1CA2CA9NAAA
SCHEMBL12095457 1.00 CA12 (0.59) CA12CA1CA2CA9NAAA
SCHEMBL11438032 1.00 CA12 (0.59) CA12CA1CA2CA9NAAA
SCHEMBL9784644 1.00 CA12 (0.59) CA12CA1CA2CA9NAAA
SCHEMBL2496736 1.00 CA12 (0.59) CA12CA1CA2CA9NAAA
SCHEMBL6564962 1.00 CA12 (0.59) CA12CA1CA2CA9NAAA
SCHEMBL6691892 1.00 CA12 (0.59) CA12CA1CA2CA9NAAA
SCHEMBL28259038 1.00 CA12 (0.59) CA12CA1CA2CA9NAAA

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
CN-116157494-A Phosphorus-free oil-soluble molybdenum complexes as high temperature scale inhibitors 埃科莱布美国股份有限公司 2023-05-23 CN disclosed
CN-116057155-A Phosphorus-free oil-soluble molybdenum complex for high-temperature naphthenic acid corrosion inhibition 埃科莱布美国股份有限公司 2023-05-02 CN disclosed
CN-110643415-B Open gear oil composition using regenerated base oil and preparation method thereof 新疆福克油品股份有限公司 2022-07-29 CN disclosed
CN-110643415-A Open gear oil composition using regenerated base oil and preparation method thereof 新疆福克油品股份有限公司 2020-01-03 CN disclosed
CN-107760419-A Lubricant composition for gasoline engine and preparation method thereof 江西福安路润滑材料有限公司 2018-03-06 CN disclosed
CN-105255562-B Lubricant oil composite 吉坤日矿日石能源株式会社 2018-02-13 CN disclosed
CN-106190503-A Lubricant oil composite 捷客斯能源株式会社 2016-12-07 CN disclosed
CN-106190504-A Lubricant oil composite 捷客斯能源株式会社 2016-12-07 CN disclosed
CN-105814178-A Grease composition 捷客斯能源株式会社 2016-07-27 CN disclosed
CN-101978036-B Lubricant composition for internal combustion engine JX NIPPON OIL & ENERGY CORP. (JP) 2016-04-13 CN disclosed
CN-105255562-A LUBRICANT OIL COMPOSITION NIPPON OIL CORP 2016-01-20 CN disclosed
CN-103805319-B Lubricating oil composition and manufacture method thereof JX NIPPON OIL & ENERGY CORPORATION (JP) 2016-01-06 CN disclosed
CN-105018189-A Lubricating oil compound JX NIPPON OIL & ENERGY CORP 2015-11-04 CN disclosed
US-7803568-B2 Carbodithioate ligands for nanotechnology and biosensing applications PURDUE RESEARCH FOUNDATION (US) 2010-09-28 US disclosed
US-20080124776-A1 Carbodithioate Ligands For Nanotechnology and Methods of Use NATIONAL SCIENCE FOUNDATION 2008-05-29 US disclosed
US-20060240489-A1 Carbodithioate ligands for nanotechnology and biosensing applications NATIONAL SCIENCE FOUNDATION 2006-10-26 US 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-20060240489-A1 Carbodithioate ligands for nanotechnology and biosensing applications SPR, ICMT, TST CA12 109/4885CA1 819/4885CA2 466/4885

“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.