SCHEMBL6545657

SCHEMBL6545657

CN1CCN(C(C(=O)Nc2ccc(N)cc2C(=O)c2ccccc2)c2ccccc2)CC1

nearest known ligand 0.75

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 14/20 0.75
SMN1; SMN2 Q16637 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
ALDH1A1 P00352 3/20 0.46
LMNA P02545 1/20 0.45

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
SCHEMBL6547590 0.84 ABCB1 (0.70) ABCB1SMN1; SMN2KMT2AALDH1A1LMNA
SCHEMBL6545622 0.79 CYP1A2 (0.54) ABCB1MEN1KMT2AALDH1A1LMNA
SCHEMBL12489950 0.74 ABCB1 (0.58) ABCB1ALDH1A1
SCHEMBL6812211 0.73 CASP1 (0.57) SMN1; SMN2ALDH1A1LMNA
SCHEMBL28073429 0.72 SLC1A2 (0.46) ABCB1KMT2AALDH1A1
SCHEMBL7752909 0.71 MAPT (0.68) SMN1; SMN2MEN1KMT2AALDH1A1LMNA
SCHEMBL31541226 0.71 MAPT (0.58) MEN1KMT2AALDH1A1LMNA
SCHEMBL7753930 0.69 MAPT (0.50) ALDH1A1LMNA
SCHEMBL26698246 0.69 CHRM1 (0.56) MEN1KMT2AALDH1A1LMNA
SCHEMBL753845 0.68 LMNA (0.69) MEN1KMT2AALDH1A1LMNA

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 5 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
EP-1257265-A2 USE OF 2-PHENYLENE DIAMINE DERIVATIVES FOR THE TREATMENT OF INFECTIONS Jomaa Pharmaka GmbH (DE) 2002-11-20 EP disclosed
WO-2001070026-A2 2-PHENYLENEDIAMINE DERIVATIVES AS HERBICIDES JOMAA PHARMAKA GMBH (DE) 2001-09-27 WO disclosed
WO-2001062709-A2 USE OF 2-PHENYLENE DIAMINE DERIVATIVES FOR THE TREATMENT OF INFECTIONS JOMAA PHARMAKA GMBH (DE) 2001-08-30 WO 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 245/4885SMN1; SMN2 4081/4885MEN1 3863/4885

“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.