SCHEMBL3220181

SCHEMBL3220181

CCOC(=O)N1CCc2sc(C=C3C(=O)N4C(C(=O)O)=CCC34)cc2C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC5A1 P13866 1/20 0.36
SLC5A2 P31639 1/20 0.36
MAPT P10636 5/20 0.35
GAA P10253 3/20 0.35
KDM4E B2RXH2 3/20 0.35
MEN1 O00255 3/20 0.35
ALDH1A1 P00352 3/20 0.35
KMT2A Q03164 3/20 0.35
TSHR P16473 2/20 0.35
MAPK1 P28482 2/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
POLB P06746 1/20 0.34
RXFP1 Q9HBX9 2/20 0.34
HDAC6 Q9UBN7 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
GRM5 P41594 1/20 0.32

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
SCHEMBL3220175 1.00 SLC5A1 (0.36) SLC5A1SLC5A2MAPTGAAKDM4E
SCHEMBL13424051 0.92 HDAC6 (0.31) SLC5A1SLC5A2HDAC6
SCHEMBL3225077 0.84 PRMT5 (0.35) MAPTKDM4EALDH1A1PRMT5WDR77
SCHEMBL3225082 0.84 PRMT5 (0.35) MAPTKDM4EALDH1A1PRMT5WDR77
SCHEMBL2927233 0.84 SLC5A1 (0.36) SLC5A1SLC5A2MAPTGAAKDM4E
SCHEMBL2927235 0.84 SLC5A1 (0.36) SLC5A1SLC5A2MAPTGAAKDM4E
SCHEMBL3222474 0.79 PRMT5 (0.45) MAPTGAAKDM4EMEN1ALDH1A1
SCHEMBL3261962 0.78 ABCB1 (0.41) MAPTHDAC6PRMT5WDR77
SCHEMBL13424066 0.78 HPGD (0.45) HPGDL3MBTL1PRMT5WDR77
SCHEMBL3261966 0.78 ABCB1 (0.41) MAPTHDAC6PRMT5WDR77

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-20100063023-A1 Bicyclic and Tricyclic Substituted 6-Methylidene Carbapenems as Broad Spectrum Beta-Lactamase Inhibitors WYETH (US) 2010-03-11 US claimed
US-20100063023-A1 Bicyclic and Tricyclic Substituted 6-Methylidene Carbapenems as Broad Spectrum Beta-Lactamase Inhibitors WYETH (US) 2010-03-11 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-20100063023-A1 Bicyclic and Tricyclic Substituted 6-Methylidene Carbapenems as Broad Spectrum Beta-Lactamase Inhibitors MGAM, CYP2C18, BCAT2 SLC5A1 3081/4885SLC5A2 3149/4885MAPT 2438/4885

“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.