SCHEMBL20966271

SCHEMBL20966271

CC(=O)CCc1c[nH]c(=O)[nH]c1=O

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GAA P10253 1/20 0.42
ATAD2 Q6PL18 1/20 0.42
KDM4E B2RXH2 1/20 0.39
RECQL P46063 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
SCHEMBL7599612 0.84 PARP1 (0.44) GAA
SCHEMBL15090423 0.81 GAA (0.45) SMN1; SMN2GAAATAD2
SCHEMBL27677766 0.81 PDE3B (0.48) SMN1; SMN2KDM4E
SCHEMBL4353311 0.80 DPYD (0.50) HTTSMN1; SMN2GAAATAD2
SCHEMBL13456018 0.78 GAA (0.39) GAAATAD2
SCHEMBL7598825 0.77 F13A1 (0.44) SMN1; SMN2GAA
SCHEMBL156784 0.77 ATAD2 (0.48) ATAD2
SCHEMBL7070324 0.77 GAA (0.50) HTTSMN1; SMN2GAAATAD2
SCHEMBL30132218 0.76 F13A1 (0.51) GAA
SCHEMBL31239128 0.76 MAPT (0.38) HTTSMN1; SMN2

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-20190125884-A1 COMPOUNDS AND METHODS FOR TRANS-MEMBRANE DELIVERY OF MOLECULES APOSENSE LTD. (IL) 2019-05-02 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-20190125884-A1 COMPOUNDS AND METHODS FOR TRANS-MEMBRANE DELIVERY OF MOLECULES ABCB4, ABCB1, SLCO2B1 HTT 1057/4885SMN1; SMN2 1580/4885GAA 660/4885

“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.