SCHEMBL3588443

SCHEMBL3588443

CCOC(=S)SC(=S)OCC

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.50
CYP2D6 P10635 1/20 0.50
CA12 O43570 2/20 0.48
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
CA9 Q16790 2/20 0.48
LMNA P02545 2/20 0.36
HSD17B10 Q99714 1/20 0.36
HDAC3 O15379 2/20 0.35
HDAC4 P56524 2/20 0.35
HDAC1 Q13547 2/20 0.35
HDAC7 Q8WUI4 2/20 0.35
HDAC2 Q92769 2/20 0.35
HDAC10 Q969S8 2/20 0.35
HDAC11 Q96DB2 2/20 0.35
HDAC8 Q9BY41 2/20 0.35
HDAC6 Q9UBN7 2/20 0.35
HDAC9 Q9UKV0 2/20 0.35
HDAC5 Q9UQL6 2/20 0.35
GAA P10253 2/20 0.35

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
SCHEMBL8844675 0.82
SCHEMBL10963692 0.82 ALDH1A1 (0.52) ALDH1A1CYP2D6CA12CA1CA2
Dixanthogen SCHEMBL37053 0.81 ALDH1A1 (0.50) ALDH1A1CYP2D6CA12CA1CA2
SCHEMBL27768690 0.80 ALDH1A1 (0.50) ALDH1A1CYP2D6CA12CA1CA2
SCHEMBL27661225 0.79
SCHEMBL411100 0.79
Dixanthogen SCHEMBL11408546 0.79 ALDH1A1 (0.48) ALDH1A1CYP2D6CA12CA1CA2
Dixanthogen SCHEMBL1415905 0.79 ALDH1A1 (0.48) ALDH1A1CYP2D6CA12CA1CA2
SCHEMBL16674835 0.77
SCHEMBL7280614 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0274876-A1 Process for preparing bis(ethoxythiocarbonyl)sulfide PFIZER INC. (US) 1988-07-20 EP claimed
CN-115181042-B Method for preparing di (alkoxythiocarbonyl) thioether compound and preparing cyanuric acid compound simultaneously and application thereof 中南大学 2024-05-14 CN disclosed
CN-115181042-A Method for preparing di (alkoxy thiocarbonyl) thioether compound and co-producing tristhiocyanoic acid compound and application 中南大学 2022-10-14 CN disclosed
US-20100016287-A1 COMPOUNDS HAVING AFFINITY FOR DOPAMINE D3 RECEPTOR AND USES THEREOF\ GLAXO GROUP LIMITED (GB) 2010-01-21 US disclosed
EP-1751163-A2 COMPOUNDS HAVING AFFINITY FOR DOPAMINE D3 RECEPTOR AND USES THEREOF GLAXO GROUP LIMITED (GB) 2007-02-14 EP disclosed
WO-2005118549-A2 COMPOUNDS HAVING AFFINITY FOR DOPAMINE D3 RECEPTOR AND USES THEREOF GLAXO GROUP LIMITED (GB) 2005-12-15 WO disclosed
EP-1023277-A1 NOVEL 3,4-DIARYLTHIAZOLIN-2-ONE OR -2-THIONE DERIVATIVES, PREPARATION METHODS AND USES IN THERAPY LABORATOIRES UPSA (FR) 2000-08-02 EP disclosed
WO-1999018093-A1 NOVEL 3,4-DIARYLTHIAZOLIN-2-ONE OR -2-THIONE DERIVATIVES, PREPARATION METHODS AND USES IN THERAPY LABORATOIRES UPSA (FR) 1999-04-15 WO disclosed
US-5859036-A ANTIINFLAMMATORY AGENTS, ANALGESICS LABORATORIES UPSA (FR) 1999-01-12 US disclosed
EP-0274876-B1 PROCESS FOR PREPARING BIS(ETHOXYTHIOCARBONYL)SULFIDE PFIZER INC. (US) 1991-01-30 EP disclosed
EP-0274876-A1 Process for preparing bis(ethoxythiocarbonyl)sulfide PFIZER INC. (US) 1988-07-20 EP disclosed
EP-0274876-A1 Process for preparing bis(ethoxythiocarbonyl)sulfide PFIZER INC. (US) 1988-07-20 EP disclosed
EP-0274876-A1 Process for preparing bis(ethoxythiocarbonyl)sulfide PFIZER INC. (US) 1988-07-20 EP disclosed
US-3976769-A INSECTICIDE AIRWICK INDUSTRIES, INC. (US) 1976-08-24 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-20100016287-A1 COMPOUNDS HAVING AFFINITY FOR DOPAMINE D3 RECEPTOR AND USES THEREOF\ DRD3, DRD2, SLC6A3 ALDH1A1 941/4885CYP2D6 301/4885CA12 4861/4885

“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.