SCHEMBL6545652

SCHEMBL6545652

[CH]=Cc1ccc(C=C(C#N)C#N)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 13/20 0.77
▸ ALDH1A1 P00352 12/20 0.77
▸ KMT2A Q03164 11/20 0.77
▸ MEN1 O00255 10/20 0.77
▸ KDM4E B2RXH2 8/20 0.77
▸ LMNA P02545 5/20 0.77
▸ NPSR1 Q6W5P4 4/20 0.77
▸ POLB P06746 2/20 0.77
▸ THRB P10828 1/20 0.65
▸ CISD1 Q9NZ45 1/20 0.65
▸ EGFR P00533 7/20 0.63
▸ CYP3A4 P08684 5/20 0.57
▸ HPGD P15428 5/20 0.57
▸ BLM P54132 5/20 0.57
▸ TSHR P16473 4/20 0.57
▸ NFKB1 P19838 4/20 0.57
▸ PMP22 Q01453 4/20 0.57
▸ CYP1A2 P05177 4/20 0.57
▸ APEX1 P27695 1/20 0.57
▸ SMN1; SMN2 Q16637 5/20 0.53

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
SCHEMBL17466932 0.88 MAPT (1.00) MAPTALDH1A1KMT2AMEN1KDM4E
SCHEMBL17466936 0.81 MAPT (0.85) MAPTALDH1A1KMT2AMEN1KDM4E
SCHEMBL1238796 0.79 MEN1 (1.00) MAPTALDH1A1KMT2AMEN1KDM4E
SCHEMBL17466941 0.78 MAPT (0.71) MAPTALDH1A1KMT2AMEN1KDM4E
SCHEMBL20824922 0.78 KMT2A (0.80) MAPTALDH1A1KMT2AMEN1KDM4E
SCHEMBL3369467 0.77 KMT2A (0.77) MAPTALDH1A1KMT2AMEN1KDM4E
SCHEMBL9591757 0.77 MAPT (0.77) MAPTALDH1A1KMT2AMEN1KDM4E
SCHEMBL21887201 0.77 MAPT (0.77) MAPTALDH1A1KMT2AMEN1KDM4E
SCHEMBL6824611 0.77 KMT2A (0.77) MAPTALDH1A1KMT2AMEN1KDM4E
SCHEMBL987696 0.77 MAPT (0.77) MAPTALDH1A1KMT2AMEN1KDM4E

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 14 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 claimed
US-20030036532-A1 Use of 2-phenylene diamine derivatives for the treatment of infections JOMAA PHARMAKA GMBH (DE) 2003-02-20 — — US claimed
EP-1257265-A2 USE OF 2-PHENYLENE DIAMINE DERIVATIVES FOR THE TREATMENT OF INFECTIONS Jomaa Pharmaka GmbH (DE) 2002-11-20 — — EP claimed
WO-2001070026-A2 2-PHENYLENEDIAMINE DERIVATIVES AS HERBICIDES JOMAA PHARMAKA GMBH (DE) 2001-09-27 — — WO claimed
WO-2001062709-A2 USE OF 2-PHENYLENE DIAMINE DERIVATIVES FOR THE TREATMENT OF INFECTIONS JOMAA PHARMAKA GMBH (DE) 2001-08-30 — — WO claimed
EP-1068176-A1 CYSTEINE AMIDES AS FARNESYL TRANSFERASE INHIBITORS Jomaa, Hassan (DE) 2001-01-17 — — EP claimed
WO-2000027803-A1 CYSTEINE AMIDES AS FARNESYL TRANSFERASE INHIBITORS JOMAA, HASSAN (DE) 2000-05-18 — — WO claimed
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
EP-1068176-A1 CYSTEINE AMIDES AS FARNESYL TRANSFERASE INHIBITORS Jomaa, Hassan (DE) 2001-01-17 — — EP disclosed
WO-2000027803-A1 CYSTEINE AMIDES AS FARNESYL TRANSFERASE INHIBITORS JOMAA, HASSAN (DE) 2000-05-18 — — 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 MAPT 4832/4885ALDH1A1 1419/4885KMT2A 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.

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