SCHEMBL5724433

SCHEMBL5724433

CC(C)C[C@@H](CO)NC(=O)c1csc(N2CC(O)C2)n1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.45
CNR1 P21554 3/20 0.42
OGA O60502 4/20 0.38
HDAC4 P56524 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
ACKR3 P25106 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
SCHEMBL5724431 1.00 CNR2 (0.45) CNR2CNR1OGAHDAC4HDAC6
SCHEMBL5724191 0.91 OGA (0.37) CNR2OGAACKR3
SCHEMBL5723737 0.89 POLB (0.37) CNR2CNR1OGAHDAC4HDAC6
SCHEMBL5724564 0.86 OGA (0.40) CNR2OGAACKR3
SCHEMBL5724565 0.86 OGA (0.40) CNR2OGAACKR3
SCHEMBL5724286 0.84 CNR1 (0.40) CNR2CNR1OGA
SCHEMBL5724290 0.84 CNR1 (0.40) CNR2CNR1OGA
SCHEMBL5724178 0.83 OGA (0.50) CNR2OGAACKR3
SCHEMBL5724428 0.83 OGA (0.37) CNR2OGA
SCHEMBL5724028 0.82 OGA (0.42) CNR2OGAACKR3

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 CNR2 1743/4885CNR1 657/4885OGA 3469/4885

“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.