SCHEMBL5724468

SCHEMBL5724468

COC1CN(C(=O)c2csc(N3CC(SC(C)=O)C3)n2)C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.37
KMT2A Q03164 3/20 0.34
CCNC P24863 2/20 0.34
CDK8 P49336 2/20 0.34
MEN1 O00255 1/20 0.34
CDK19 Q9BWU1 1/20 0.34
GFER P55789 1/20 0.33
RIPK1 Q13546 1/20 0.33
TRPC3 Q13507 1/20 0.32
TRPC6 Q9Y210 1/20 0.32
SCN9A Q15858 1/20 0.32
GRM5 P41594 1/20 0.32
SCD5 Q86SK9 1/20 0.32
CRBN Q96SW2 1/20 0.32
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
ADORA2A P29274 2/20 0.31
ADORA2B P29275 2/20 0.31

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
SCHEMBL5723784 0.85 KMT2A (0.40) HRH3KMT2AMEN1GFERTRPC3
SCHEMBL5724610 0.85 KMT2A (0.39) HRH3KMT2AMEN1GFERTRPC3
SCHEMBL5724462 0.84 HRH3 (0.40) HRH3KMT2ACCNCCDK8MEN1
SCHEMBL5724499 0.84 KMT2A (0.42) HRH3KMT2AMEN1GFERTRPC3
SCHEMBL5724062 0.83 TSHR (0.41) HRH3KMT2AGFERTRPC3TRPC6
SCHEMBL5724329 0.83 HPGD (0.35) HRH3KMT2AGFERTRPC3TRPC6
SCHEMBL5723626 0.82 HTR2C (0.46) HRH3
SCHEMBL5724538 0.80 HRH3 (0.37) HRH3KMT2ACCNCCDK8MEN1
SCHEMBL5724059 0.79 HRH3 (0.44) HRH3KMT2AMEN1SCD
SCHEMBL5723594 0.77 RIPK1 (0.37) HRH3CCNCCDK8CDK19RIPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1340757-B1 1-METHYLCARBAPENEM DERIVATIVES SANKYO CO (JP) 2006-10-11 EP disclosed
US-7001897-B2 1-methylcarbapenem derivatives SANKYO COMPANY, LIMITED (JP) 2006-02-21 US disclosed
US-20040014962-A1 1-Methylcarbapenem derivatives SANKYO COMPANY, LIMITED (JP) 2004-01-22 US disclosed
EP-1340757-A1 1-METHYLCARBAPENEM DERIVATIVES Sankyo Company, Limited (JP) 2003-09-03 EP 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-20040014962-A1 1-Methylcarbapenem derivatives CD14, CPT1A, ACMSD HRH3 3678/4885KMT2A 2404/4885CCNC 4288/4885

“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.