SCHEMBL3480307

SCHEMBL3480307

CC(=O)Oc1ccc(C(=O)NCCOc2c(OCCNC(=O)c3ccc(OC(C)=O)c(OC(C)=O)c3)c(F)c3sc(S(=O)(=O)NCP(=O)(O)Oc4ccc(C#N)c(C(F)(F)F)c4)cc3c2F)cc1OC(C)=O

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 4/20 0.34
CCR2 P41597 3/20 0.32
CCR1 P32246 1/20 0.32
CCR5 P51681 1/20 0.32
AR P10275 4/20 0.31
SLC22A12 Q96S37 1/20 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
SCHEMBL12979614 0.94 PLA2G7 (0.32) PLA2G7CCR2AR
SCHEMBL3997571 0.93 TRPV4 (0.32)
SCHEMBL13021454 0.91 TRPV4 (0.31)
SCHEMBL3480818 0.87 AR (0.32) AR
SCHEMBL12979325 0.86 TRPV4 (0.32)
SCHEMBL3996581 0.86 PLA2G7 (0.35) PLA2G7CCR2CCR1CCR5AR
SCHEMBL13021440 0.84 PLA2G7 (0.34) PLA2G7CCR2CCR1CCR5AR
SCHEMBL13024070 0.84 TRPV4 (0.31) PLA2G7
SCHEMBL3950721 0.83 TRPV4 (0.36) PLA2G7ARSLC22A12
SCHEMBL13021131 0.81 TRPV4 (0.34)

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
US-20100317625-A1 NOVEL SULFONAMIDOMETHYLPHOSPHONATE INHIBITORS OF BETA-LACTAMASE 92229129 QUEBEC INC. (CA) 2010-12-16 US disclosed
US-20100317625-A1 NOVEL SULFONAMIDOMETHYLPHOSPHONATE INHIBITORS OF BETA-LACTAMASE 92229129 QUEBEC INC. (CA) 2010-12-16 US disclosed
WO-2007139729-A1 NOVEL SULFONAMIDOMETHYLPHOSPHONATE INHIBITORS OF BETA-LACTAMASE MERCK & CO., INC. (US) 2007-12-06 WO 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-20100317625-A1 NOVEL SULFONAMIDOMETHYLPHOSPHONATE INHIBITORS OF BETA-LACTAMASE MGAM, BPGM, PPME1 PLA2G7 289/4885CCR2 3555/4885CCR1 4792/4885

“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.