SCHEMBL5029924

SCHEMBL5029924

CC(C)(C)OC(=O)CN1C(=O)CCN(CC(=O)O)C2=CC=CCC21

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 2/20 0.36
PLA2G5 P39877 2/20 0.36
ITGB3 P05106 8/20 0.32
ITGA2B P08514 8/20 0.32
CASP3 P42574 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL5023981 0.79 CASP3 (0.33) PLA2G10PLA2G5CASP3KDM4EALDH1A1
SCHEMBL6361822 0.75 PLA2G10 (0.41) PLA2G10PLA2G5ITGB3ITGA2BKDM4E
SCHEMBL5025458 0.68 MEN1 (0.43) PLA2G10PLA2G5CASP3
SCHEMBL5029922 0.67 PLA2G10 (0.31) PLA2G10PLA2G5CASP3
SCHEMBL6283587 0.67 LMNA (0.48) PLA2G10PLA2G5KDM4EALDH1A1
SCHEMBL5030092 0.65 MEN1 (0.45) PLA2G10PLA2G5KDM4EALDH1A1
SCHEMBL17951050 0.65 PLA2G10 (0.42) PLA2G10PLA2G5KDM4EALDH1A1
SCHEMBL18204610 0.65 PLA2G10 (0.42) PLA2G10PLA2G5KDM4EALDH1A1
SCHEMBL5023979 0.65 PLA2G10 (0.33) PLA2G10PLA2G5
SCHEMBL7126798 0.65 CHRM2 (0.34) PLA2G10PLA2G5

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-20080221082-A1 Ligands of Integrin Receptors ABBOTT GMBH & CO. KG (DE) 2008-09-11 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-20080221082-A1 Ligands of Integrin Receptors ITGB3, ITGAV, ITGA2B PLA2G10 3666/4885PLA2G5 2330/4885ITGB3 1/4885

“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.