SCHEMBL3190229

SCHEMBL3190229

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

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.36
ALDH1A1 P00352 3/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CA12 O43570 5/20 0.36
CA1 P00915 5/20 0.36
CA2 P00918 5/20 0.36
CA9 Q16790 5/20 0.36
HCAR2 Q8TDS4 1/20 0.33
ALOX15 P16050 1/20 0.32
LMNA P02545 1/20 0.31
ESR1 P03372 1/20 0.30
CHRM1 P11229 1/20 0.30
TSHR P16473 1/20 0.30
SLC6A2 P23975 1/20 0.30
KDR P35968 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL2237577 0.97 HPGD (0.38) HPGDALDH1A1MAPK1SMN1; SMN2CA12
SCHEMBL2746578 0.97
Hydrochloric Acid SCHEMBL11088219 0.94
Propane SCHEMBL28432693 0.94 HPGD (0.36) HPGDALDH1A1MAPK1SMN1; SMN2CA12
SCHEMBL2126842 0.94 HPGD (0.36) HPGDALDH1A1MAPK1SMN1; SMN2CA12
SCHEMBL701336 0.94 HPGD (0.36) HPGDALDH1A1MAPK1SMN1; SMN2CA12
SCHEMBL6298110 0.94 HPGD (0.36) HPGDALDH1A1MAPK1SMN1; SMN2CA12
SCHEMBL27690894 0.92 HPGD (0.39) HPGDALDH1A1MAPK1SMN1; SMN2CA12
SCHEMBL10767942 0.92 HPGD (0.39) HPGDALDH1A1MAPK1SMN1; SMN2CA12
SCHEMBL6564983 0.90 HPGD (0.38) HPGDALDH1A1MAPK1SMN1; SMN2CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107428211-B Tyre for vehicle wheels 株式会社普利司通 2020-04-10 CN disclosed
CN-107428212-B Tyre for vehicle wheels 株式会社普利司通 2020-03-31 CN disclosed
US-20100016634-A1 METHOD FOR STABILIZING CARBODIIMIDE DERIVATIVE AND STABILIZED COMPOSITION THEREOF KANEKA CORPORATION (JP) 2010-01-21 US disclosed
EP-2058299-A1 METHOD FOR STABILIZING CARBODIIMIDE DERIVATIVE AND STABILIZED COMPOSITION THEREOF Kaneka Corporation (JP) 2009-05-13 EP disclosed
US-5387160-A A vulcanized belt is made of hydrogenated acrylonitrile-butadiene rubber, sulfur and a copper dithiocarbamates; tensile strength, elongation, durability MITSUBOSHI BELTING LTD. (JP) 1995-02-07 US disclosed
US-4842753-A CONTAINING THICKENER AND COPPER DIALKYL DITHIOCARBAMATE SHIN-ETSU CHEMICAL CO., LTD. (JP) 1989-06-27 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-20100016634-A1 METHOD FOR STABILIZING CARBODIIMIDE DERIVATIVE AND STABILIZED COMPOSITION THEREOF NCAPD2, SOD1, SCO2 HPGD 369/4885ALDH1A1 1582/4885MAPK1 4167/4885

“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.