SCHEMBL820166

SCHEMBL820166

CCCCOC(N)=S.CCCCOC(N)=S.[Cu]

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.48
CA2 P00918 4/20 0.48
CA12 O43570 3/20 0.48
CA9 Q16790 3/20 0.48
ALDH1A1 P00352 2/20 0.46
ATM Q13315 1/20 0.43
ADRB2 P07550 1/20 0.42
ADRB1 P08588 1/20 0.42
ADRB3 P13945 1/20 0.42
TSHR P16473 5/20 0.40
RAB9A P51151 2/20 0.40
HPGD P15428 1/20 0.40
MAPT P10636 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.40
HCAR2 Q8TDS4 1/20 0.38
LMNA P02545 2/20 0.37
CYP1A2 P05177 2/20 0.37
CYP2C19 P33261 2/20 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
SCHEMBL28034223 1.00
SCHEMBL331242 0.97 CA1 (0.50) CA1CA2CA12CA9ALDH1A1
SCHEMBL1692167 0.97
SCHEMBL10668940 0.95 CA12 (0.56) CA1CA2CA12CA9ALDH1A1
SCHEMBL18447552 0.95 CA1 (0.48) CA1CA2CA12CA9ALDH1A1
SCHEMBL35746 0.95 CA1 (0.48) CA1CA2CA12CA9ALDH1A1
SCHEMBL212535 0.95 CA1 (0.48) CA1CA2CA12CA9ALDH1A1
SCHEMBL2492944 0.95 CA1 (0.48) CA1CA2CA12CA9ALDH1A1
SCHEMBL11213345 0.95 CA1 (0.48) CA1CA2CA12CA9ALDH1A1
SCHEMBL28857708 0.95 CA1 (0.48) CA1CA2CA12CA9ALDH1A1

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 185 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117561232-A Anti-scaling composition and use thereof 法国特种经营公司 2024-02-13 CN claimed
CN-117511310-A Inorganic flexible spraying material for underground air leakage blocking and application thereof 上海无忧树新材料科技有限公司 2024-02-06 CN claimed
CN-116675245-A Preparation method of zinc sulfide one-dimensional nanomaterial with controllable crystallographic orientation 合肥工业大学 2023-09-01 CN claimed
CN-114560504-B Preparation method of manganese sulfide nano cone material 合肥工业大学 2023-08-22 CN claimed
CN-116063214-A Continuous synthesis method of dibutyl dithio carbamate 鹤壁元昊化工有限公司 2023-05-05 CN claimed
CN-115721775-A Composite modified biological hydrogel dressing and preparation process thereof 海南苏生生物科技有限公司 2023-03-03 CN claimed
US-20220411542-A1 COMPOSITION FOR THE IMMEDIATE TERMINATION OF A FREE-RADICAL POLYMERIZATION AND USES THEREOF RHODIA OPERATIONS (FR) 2022-12-29 US claimed
CN-112851596-B Oxazolidine-containing radiation-curable urethane (meth) acrylate and preparation method thereof 广东石油化工学院 2022-12-27 CN claimed
CN-112341426-B Xylitol-containing radiation-curable (methyl) acrylate compound and preparation method thereof 广东石油化工学院 2022-01-07 CN claimed
CN-112266375-B Xylitol-containing radiation-curable urethane (meth) acrylate compound and preparation method thereof 广东石油化工学院 2022-01-07 CN claimed
WO-2020038496-A2 COMPOSITION FOR THE IMMEDIATE TERMINATION OF A FREE-RADICAL POLYMERIZATION AND USES THEREOF RHODIA OPERATIONS (FR) 2020-02-27 WO claimed
EP-3544946-A1 DIPHENOL PRILLS AND METHOD FOR OBTAINING THE SAME Rhodia Operations (FR) 2019-10-02 EP claimed
WO-2018153913-A1 DIPHENOL PRILLS AND METHOD FOR OBTAINING THE SAME RHODIA OPERATIONS (FR) 2018-08-30 WO claimed
EP-3347333-A1 USE OF POLYMERIZATION INHIBITOR COMPOSITIONS Rhodia Operations (FR) 2018-07-18 EP claimed
WO-2017041204-A1 USE OF POLYMERIZATION INHIBITOR COMPOSITIONS RHODIA OPERATIONS (FR) 2017-03-16 WO claimed
EP-1769024-A4 RUBBER COMPOSITION AND TIRE COMPRISING SAME MICHELIN SOC TECH (FR) 2008-03-12 EP claimed
JP-2008505201-A 2008-02-21 JP claimed
US-20070100042-A1 Rubber composition and tire comprising same MICHELIN RECHERCHE ET TECHNIQUE, S.A. (CH) 2007-05-03 US claimed
EP-1769024-A1 RUBBER COMPOSITION AND TIRE COMPRISING SAME Societe de Technologie Michelin (FR) 2007-04-04 EP claimed
WO-2006011877-A1 RUBBER COMPOSITION AND TIRE COMPRISING SAME SOCIETE DE TECHNOLOGIE MICHELIN (FR) 2006-02-02 WO claimed

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-20220411542-A1 COMPOSITION FOR THE IMMEDIATE TERMINATION OF A FREE-RADICAL POLYMERIZATION AND USES THEREOF NOX4, GPX4, TXN CA1 2039/4885CA2 3748/4885CA12 2395/4885

“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.