SCHEMBL2808303

SCHEMBL2808303

CCCCCCCCc1ccc(OCC(Cn2cc(C(=O)CCCCC(=O)OC)c3cc(C(=O)OC)ccc32)(OC)OC)cc1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PLA2G4A P47712 17/20 0.58
MDH1 P40925 2/20 0.46

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
SCHEMBL2810898 0.93 PLA2G4A (0.55) PLA2G4AMDH1
SCHEMBL2806139 0.85 PLA2G4A (0.79) PLA2G4A
SCHEMBL2835991 0.84 PLA2G4A (0.78) PLA2G4A
SCHEMBL2804337 0.84 PLA2G4A (0.58) PLA2G4AMDH1
SCHEMBL2807125 0.83 PLA2G4A (0.57) PLA2G4AMDH1
SCHEMBL2808305 0.78 PLA2G4A (0.49) PLA2G4A
SCHEMBL2806998 0.74 AKR1C3 (0.39) PLA2G4A
SCHEMBL13127470 0.73 PLA2G4A (1.00) PLA2G4A
SCHEMBL2810890 0.73 PLA2G4A (0.80) PLA2G4A
SCHEMBL2810903 0.73 PLA2G4A (0.48) PLA2G4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100240718-A1 NOVEL HETEROARYL-SUBSTITUTED ACETONE DERIVATIVE, SUITABLE FOR INHIBITING PHOSPHOLIPASE A2 WESTFALISCHE WILHELMS UNIVERSITÄT MÜNSTER (DE) 2010-09-23 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-20100240718-A1 NOVEL HETEROARYL-SUBSTITUTED ACETONE DERIVATIVE, SUITABLE FOR INHIBITING PHOSPHOLIPASE A2 PLD2, PLA2G1B, PLA2G4A PLA2G4A 3/4885MDH1 2682/4885

“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.