SCHEMBL2807308

SCHEMBL2807308

COC(=O)CCCCC(=O)c1cn(CC(O)COc2ccc(-c3ccccc3)cc2)c2ccc(C(=O)OC)cc12

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.44
POLB P06746 1/20 0.44
LMNA P02545 4/20 0.43
PLA2G4A P47712 8/20 0.42
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
USP2 O75604 1/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TP53 P04637 1/20 0.40
THRB P10828 1/20 0.40
PRMT5 O14744 1/20 0.39
WDR77 Q9BQA1 1/20 0.39

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
SCHEMBL2806882 0.93 PLA2G4A (0.45) MAPTPOLBLMNAPLA2G4AALDH1A1
SCHEMBL2804337 0.86 PLA2G4A (0.58) MAPTPOLBPLA2G4A
SCHEMBL2808266 0.85 PLA2G4A (0.59) MAPTPLA2G4ASMN1; SMN2
SCHEMBL2807125 0.85 PLA2G4A (0.57) MAPTPOLBPLA2G4A
SCHEMBL2809726 0.78 PLA2G4A (0.61) PLA2G4A
SCHEMBL2807309 0.77 PLA2G2A (0.43) MAPTPOLBLMNAPLA2G4AALDH1A1
SCHEMBL2806823 0.74 PLA2G4A (0.54) PLA2G4A
SCHEMBL2806318 0.73 PLA2G4A (0.58) MAPTPOLBPLA2G4ATP53THRB
SCHEMBL2805611 0.72 CNR2 (0.50) MAPTPLA2G4AALDH1A1HSD17B10
SCHEMBL2806139 0.71 PLA2G4A (0.79) 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 3 patents. 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
EP-2215059-A2 NOVEL HETEROARYL-SUBSTITUTED ACETONE DERIVATIVE, SUITABLE FOR INHIBITING PHOSPHOLIPASE A2 Westfälische Wilhelms-Universität Münster (DE) 2010-08-11 EP disclosed
WO-2009040314-A2 NOVEL HETEROARYL-SUBSTITUTED ACETONE DERIVATIVES, SUITABLE FOR INHIBITING PHOSPHOLIPASE A2 Westfälische Wilhelms Universität Münster (DE) 2009-04-02 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-20100240718-A1 NOVEL HETEROARYL-SUBSTITUTED ACETONE DERIVATIVE, SUITABLE FOR INHIBITING PHOSPHOLIPASE A2 PLD2, PLA2G1B, PLA2G4A MAPT 4523/4885POLB 3188/4885LMNA 2737/4885

“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.