SCHEMBL1775890

SCHEMBL1775890

CCCCCN(N)C(=S)S

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 6/20 0.43
CA1 P00915 6/20 0.43
CA2 P00918 6/20 0.43
CA9 Q16790 6/20 0.43
MGLL Q99685 1/20 0.39
DNM1 Q05193 3/20 0.37
ABCB11 O95342 1/20 0.37
CYP2E1 P05181 1/20 0.37
PTGS1 P23219 1/20 0.37
HTT P42858 1/20 0.37
GSDMD P57764 1/20 0.37
ALDH1A1 P00352 1/20 0.35
ALDH2 P05091 1/20 0.35
GBA1 P04062 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
S1PR2 O95136 1/20 0.31
S1PR1 P21453 1/20 0.31
S1PR3 Q99500 1/20 0.31
S1PR5 Q9H228 1/20 0.31
TSHR P16473 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
SCHEMBL11809610 0.79 CA12 (0.45) CA12CA1CA2CA9MGLL
SCHEMBL48330 0.76 CA12 (0.58) CA12CA1CA2CA9MGLL
Potassium Ion SCHEMBL1776364 0.76 CA12 (0.57) CA12CA1CA2CA9MGLL
SCHEMBL9812357 0.76 CA12 (0.47) CA12CA1CA2CA9MGLL
SCHEMBL10802675 0.76 CA12 (0.47) CA12CA1CA2CA9MGLL
SCHEMBL6291871 0.74 CA12 (0.61) CA12CA1CA2CA9MGLL
SCHEMBL4787671 0.74 CA12 (0.61) CA12CA1CA2CA9MGLL
SCHEMBL2922927 0.74 CA12 (0.61) CA12CA1CA2CA9MGLL
Selenium SCHEMBL11495064 0.74 CA12 (0.56) CA12CA1CA2CA9MGLL
SCHEMBL2496734 0.74 CA12 (0.61) CA12CA1CA2CA9MGLL

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-2640373-A1 TREATMENT OF TYPE II DIABETES AND DIABETES-ASSOCIATED DISEASES WITH SAFE CHEMICAL MITOCHONDRIAL UNCOUPLERS University Of Medicine And Dentistry Of New Jersey (US) 2013-09-25 EP claimed
US-20130231312-A1 TREATMENT OF TYPE II DIABETES AND DIABETES-ASSOCIATED DISEASES WITH SAFE CHEMICAL MITOCHONDRIAL UNCOUPLERS NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2013-09-05 US claimed
WO-2012068274-A9 TREATMENT OF TYPE II DIABETES AND DIABETES-ASSOCIATED DISEASES WITH SAFE CHEMICAL MITOCHONDRIAL UNCOUPLERS UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY (US) 2013-08-01 WO claimed
WO-2012068274-A1 TREATMENT OF TYPE II DIABETES AND DIABETS-ASSOCIATED DISEASES WITH SAFE CHEMICAL MITOCHONDRIAL UNCOUPLERS UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY (US) 2012-05-24 WO claimed
US-20230414637-A1 NICLOSAMIDE NASAL AND THROAT SPRAY NEEDHAM MATERIAL SCIENCE LLC 2023-12-28 US disclosed
WO-2022099323-A1 NICLOSAMIDE NASAL AND THROAT SPRAY NEEDHAM MATERIAL SCIENCE LLC (US) 2022-05-12 WO disclosed
CN-103415287-A Treatment of type II diabetes and diabetes related disorders with safe mitochondrial uncoupling chemicals UNIV NEW JERSEY MED 2013-11-27 CN disclosed
EP-2640373-A1 TREATMENT OF TYPE II DIABETES AND DIABETES-ASSOCIATED DISEASES WITH SAFE CHEMICAL MITOCHONDRIAL UNCOUPLERS University Of Medicine And Dentistry Of New Jersey (US) 2013-09-25 EP disclosed
US-20130231312-A1 TREATMENT OF TYPE II DIABETES AND DIABETES-ASSOCIATED DISEASES WITH SAFE CHEMICAL MITOCHONDRIAL UNCOUPLERS NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2013-09-05 US disclosed
WO-2012068274-A9 TREATMENT OF TYPE II DIABETES AND DIABETES-ASSOCIATED DISEASES WITH SAFE CHEMICAL MITOCHONDRIAL UNCOUPLERS UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY (US) 2013-08-01 WO disclosed
WO-2012068274-A1 TREATMENT OF TYPE II DIABETES AND DIABETS-ASSOCIATED DISEASES WITH SAFE CHEMICAL MITOCHONDRIAL UNCOUPLERS UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY (US) 2012-05-24 WO disclosed
US-20110112079-A1 PHOSPHODIESTERASE INHIBITORS THE GOV. OF THE U.S.A. AS REPRESENTED BY THE SECRETARY OF THE DEPT. OF HEALTH AND HUMAN SERVICES 2011-05-12 US disclosed
EP-2231669-A1 PHOSPHODIESTERASE INHIBITORS The U.S.A. As Represented By The Secretary, Department Of Health And Human Services (US) 2010-09-29 EP disclosed
WO-2009089027-A1 PHOSPHODIESTERASE INHIBITORS GOVERNMENT OF THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICE, NATIONAL INSTITUTES OF HEALTH (US) 2009-07-16 WO 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 (2 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-20130231312-A1 TREATMENT OF TYPE II DIABETES AND DIABETES-ASSOCIATED DISEASES WITH SAFE CHEMICAL MITOCHONDRIAL UNCOUPLERS AK2, UQCRC2, GOT2 CA12 1978/4885CA1 3441/4885CA2 280/4885
US-20110112079-A1 PHOSPHODIESTERASE INHIBITORS PDE5A, PDE3B, PDE3A CA12 3542/4885CA1 2560/4885CA2 607/4885

“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.