SCHEMBL4986010

SCHEMBL4986010

CC(=O)Nc1nc(CCc2ccc(NC(NC(=O)O)(N(C(=O)O)C(C)(C)C)C(C)(C)C)cc2)c(C(=O)N2CCN(S(C)(=O)=O)CC2)s1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 13/20 0.36
MAPT P10636 1/20 0.33
GAA P10253 1/20 0.33
POLB P06746 1/20 0.32
KMT2A Q03164 2/20 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
SCHEMBL4991713 0.90 AOC3 (0.34) AOC3
SCHEMBL4987507 0.87 AOC3 (0.41) AOC3POLBKMT2A
SCHEMBL4988776 0.86 AOC3 (0.35) AOC3
SCHEMBL4988488 0.86 AOC3 (0.32) AOC3
SCHEMBL4986328 0.86 OGA (0.34) AOC3POLBKMT2A
SCHEMBL4991741 0.83 AOC3 (0.45) AOC3MAPTPOLBKMT2A
SCHEMBL4986002 0.83 AOC3 (0.36) AOC3MAPTGAAPOLBKMT2A
SCHEMBL4871391 0.82 AOC3 (0.39) AOC3
SCHEMBL4877774 0.82 NPC1 (0.38) AOC3POLB
SCHEMBL4987280 0.82 AOC3 (0.37) AOC3KMT2A

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-20080119462-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE SUCAMPO AG (CH) 2008-05-22 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-20080119462-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE VCAM1, ICAM1, VAPB AOC3 202/4885MAPT 430/4885GAA 1570/4885

“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.