SCHEMBL6545867

SCHEMBL6545867

CCCCCCCCCCCCCCCC(=O)NCCC(=O)Nc1ccc(NC(=O)Cc2ccccc2)c(C(=O)c2ccccc2)c1

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
ALDH1A1 P00352 1/20 0.49

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
SCHEMBL7755331 0.95 ALDH1A1 (0.49) ABCB1ALDH1A1
SCHEMBL6545613 0.91 ABCB1 (0.47) ABCB1ALDH1A1
SCHEMBL6546452 0.89 ABCB1 (0.52) ABCB1ALDH1A1
SCHEMBL6545874 0.86 ABCB1 (0.46) ABCB1
SCHEMBL2226912 0.81 ABCB1 (0.58) ABCB1
SCHEMBL12919766 0.77 ALDH1A1 (0.62) ALDH1A1
SCHEMBL7051488 0.74 APP (0.47) ABCB1
SCHEMBL8724093 0.72 PSMB11 (0.71) MEN1KMT2AALDH1A1
SCHEMBL8979987 0.71 ALDH1A1 (0.63) MEN1KMT2AALDH1A1
SCHEMBL7753317 0.70

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1257265-B1 USE OF 2-PHENYLENE DIAMINE DERIVATIVES FOR THE TREATMENT OF INFECTIONS BIOAGENCY AG (DE) 2004-01-21 EP disclosed
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 ABCB1 245/4885MEN1 3863/4885KMT2A 1743/4885

“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.