SCHEMBL6097794

SCHEMBL6097794

CCNC(=S)Nc1c(C)cccc1C

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.60
ATM Q13315 1/20 0.60
ALDH1A1 P00352 5/20 0.55
ALOX12 P18054 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
GAA P10253 5/20 0.54
MAPT P10636 2/20 0.54
PKM P14618 1/20 0.54
MAPK1 P28482 1/20 0.54
LMNA P02545 2/20 0.53
HTT P42858 1/20 0.52

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
SCHEMBL20672953 0.86 POLB (0.62) POLBATMALDH1A1ALOX12SMN1; SMN2
SCHEMBL15484311 0.83 LMNA (0.69) POLBATMALDH1A1ALOX12SMN1; SMN2
SCHEMBL11137403 0.83 POLB (0.48) POLBATMALDH1A1ALOX12SMN1; SMN2
SCHEMBL11052356 0.83 POLB (0.51) POLBATMALDH1A1ALOX12SMN1; SMN2
SCHEMBL20026965 0.83 ALDH1A1 (0.60) POLBATMALDH1A1ALOX12SMN1; SMN2
SCHEMBL21292015 0.82 LMNA (0.56) POLBATMALDH1A1ALOX12SMN1; SMN2
SCHEMBL11757878 0.81 KMT2A (0.69) POLBATMALDH1A1ALOX12SMN1; SMN2
SCHEMBL19420682 0.81 ALDH1A1 (0.58) POLBATMALDH1A1ALOX12SMN1; SMN2
SCHEMBL11541523 0.79 ALDH1A1 (0.57) POLBALDH1A1ALOX12SMN1; SMN2GAA
SCHEMBL11282594 0.79 L3MBTL1 (0.70) POLBALDH1A1ALOX12SMN1; SMN2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7135492-B2 Increases the concentration of high density lipoprotein cholesterol in the blood; dyslipoproteinemia; angina pectoris, myocardial infarction, antiarrhythmia agents, heart failure, kidney failure stroke, peripheral arterial occulsion WYETH (US) 2006-11-14 US disclosed
US-20030119889-A1 1,3-Disubstituted-2- thioxo-imidazolidine-4,5-dione derivatives useful in the treatment of atherosclerosis WYETH 2003-06-26 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-20030119889-A1 1,3-Disubstituted-2- thioxo-imidazolidine-4,5-dione derivatives useful in the treatment of atherosclerosis FFAR4, FFAR1, MSR1 POLB 2558/4885ATM 2356/4885ALDH1A1 896/4885

“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.