SCHEMBL5723634

SCHEMBL5723634

CN(C)C(=O)c1csc(N2CCC(OS(C)(=O)=O)CC2)n1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.44
OGA O60502 1/20 0.44
SMN1; SMN2 Q16637 5/20 0.41
SCD O00767 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
RXFP1 Q9HBX9 1/20 0.40
RAB9A P51151 4/20 0.36
NPC1 O15118 3/20 0.36
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
HPGD P15428 1/20 0.35
BLM P54132 1/20 0.35
KMT2A Q03164 1/20 0.35
ESR2 Q92731 1/20 0.35

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
SCHEMBL5724141 0.88 OGA (0.41) HRH3OGASMN1; SMN2SCDL3MBTL1
SCHEMBL5723644 0.86 HRH3 (0.59) HRH3OGASMN1; SMN2SCDL3MBTL1
SCHEMBL5723977 0.84 OGA (0.49) HRH3OGASMN1; SMN2SCDRAB9A
SCHEMBL5723678 0.84 HRH3 (0.46) HRH3OGASCD
SCHEMBL5723822 0.82 OGA (0.47) HRH3OGASMN1; SMN2SCDL3MBTL1
SCHEMBL5724480 0.80 HRH3 (0.45) HRH3OGASMN1; SMN2SCDL3MBTL1
SCHEMBL5724229 0.79 HRH3 (0.54) HRH3OGASMN1; SMN2SCDRAB9A
SCHEMBL5724017 0.79 HRH3 (0.54) HRH3OGASMN1; SMN2SCDRAB9A
SCHEMBL5723756 0.76 OGA (0.45) HRH3OGASMN1; SMN2SCDL3MBTL1
SCHEMBL5725173 0.76 OGA (0.46) HRH3OGASMN1; SMN2L3MBTL1RXFP1

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 3678/4885OGA 3469/4885SMN1; SMN2 1508/4885

“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.