SCHEMBL7051486

SCHEMBL7051486

O=C(/C=C/c1ccc(OCc2ccccc2)cc1)NCCC(=O)Nc1ccc(NC(=O)Cc2ccccc2)c(C(=O)c2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
APP P05067 3/20 0.47
SENP1 Q9P0U3 1/20 0.46
GSK3B P49841 1/20 0.45
BACE1 P56817 1/20 0.45
LTA4H P09960 1/20 0.45
ABCB1 P08183 1/20 0.43

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
SCHEMBL7051488 1.00 APP (0.47) APPSENP1GSK3BBACE1LTA4H
SCHEMBL7051378 0.78 THRB (0.49)
SCHEMBL7051375 0.78 THRB (0.49)
SCHEMBL7048203 0.77 MEN1 (0.47)
SCHEMBL7051491 0.76 ABCB1 (0.44) ABCB1
SCHEMBL7051490 0.76 ABCB1 (0.44) ABCB1
SCHEMBL6546898 0.75 GSK3B (0.67) APPGSK3BBACE1
SCHEMBL6546896 0.75 GSK3B (0.67) APPGSK3BBACE1
SCHEMBL18655903 0.74 LTB4R (0.51)
SCHEMBL6545867 0.74 ABCB1 (0.50) ABCB1

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-20030036532-A1 Use of 2-phenylene diamine derivatives for the treatment of infections JOMAA PHARMAKA GMBH (DE) 2003-02-20 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-20030036532-A1 Use of 2-phenylene diamine derivatives for the treatment of infections HRH2, ASPH, NQO2 APP 3007/4885SENP1 4534/4885GSK3B 3157/4885

“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.