SCHEMBL5133464

SCHEMBL5133464

CCOC(=O)c1sc2[nH]c(=O)n(C)c(=O)c2c1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.48
RXFP1 Q9HBX9 2/20 0.48
PPARG P37231 1/20 0.48
NCOA2 Q15596 1/20 0.48
ALDH1A1 P00352 7/20 0.47
KDM4E B2RXH2 5/20 0.45
GAA P10253 3/20 0.45
LMNA P02545 1/20 0.45
CYP1A2 P05177 2/20 0.43
HTT P42858 1/20 0.43
TSHR P16473 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
RAB9A P51151 3/20 0.42
HPGD P15428 3/20 0.42
HSD17B10 Q99714 2/20 0.42
ALOX15 P16050 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
NPC1 O15118 2/20 0.41

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
SCHEMBL5032099 0.85 MAPT (0.47) MAPTRXFP1PPARGNCOA2ALDH1A1
SCHEMBL14945613 0.85 KMT2A (0.55) MAPTRXFP1PPARGNCOA2ALDH1A1
SCHEMBL19993991 0.84 MAPT (0.44) MAPTRXFP1PPARGNCOA2ALDH1A1
SCHEMBL18096859 0.83 MAPT (0.45) MAPTRXFP1PPARGNCOA2ALDH1A1
SCHEMBL14950587 0.82 KMT2A (0.45) MAPTRXFP1PPARGNCOA2ALDH1A1
SCHEMBL14945486 0.81 MAPT (0.44) MAPTRXFP1PPARGNCOA2ALDH1A1
SCHEMBL18097537 0.81 MAPT (0.41) MAPTRXFP1PPARGNCOA2ALDH1A1
SCHEMBL18097017 0.81 MAPT (0.41) MAPTRXFP1PPARGNCOA2ALDH1A1
SCHEMBL19923946 0.81 MAPT (0.41) MAPTRXFP1PPARGNCOA2ALDH1A1
SCHEMBL23479896 0.80 POLB (0.48) MAPTRXFP1PPARGNCOA2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1989210-A2 A2A ADENOSINE RECEPTOR ANTAGONISTS CV THERAPEUTICS, INC. (US) 2008-11-12 EP disclosed
WO-2007103776-A2 A2A ADENOSINE RECEPTOR ANTAGONISTS CV THERAPEUTICS, INC. (US) 2007-09-13 WO disclosed
US-20070208040-A1 e.g. 3-ethyl-5-methyl-1,3-dihydrothiopheno[2,3-d]pyrimidine-2,4-dione; neurodegenerative disorders, antiischemic agent, antidepressant, attention deficit disorder, hepatic fibrosis, cirrhosis of the liver, and drug addiction GILEAD PALO ALTO, INC. 2007-09-06 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-20070208040-A1 e.g. 3-ethyl-5-methyl-1,3-dihydrothiopheno[2,3-d]pyrimidine-2,4-dione; neurodegenerative disorders, antiischemic agent, antidepressant, attention deficit disorder, hepatic fibrosis, cirrhosis of the liver, and drug addiction CHRNE, CHRNA3, CHRNA1 MAPT 403/4885RXFP1 3595/4885PPARG 990/4885

“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.