SCHEMBL1405759

SCHEMBL1405759

COC(=O)N(C1c2ccccc2-c2ccccc21)[C@@H](Cc1ccc(OC)c(OC)c1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LDHA P00338 1/20 0.51
▸ MMP1 P03956 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ FPR2 P25090 1/20 0.43
▸ KDM1A O60341 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL5407004 0.87 CTRB1 (0.40) ALDH1A1
SCHEMBL30510366 0.87 CTRB1 (0.40) ALDH1A1
SCHEMBL4600752 0.87 CTRB1 (0.40) ALDH1A1
SCHEMBL4600067 0.87 CTRB1 (0.40) ALDH1A1
SCHEMBL4034324 0.87 PPARG (0.41) MMP1KMT2AMEN1
SCHEMBL4034320 0.87 PPARG (0.41) MMP1KMT2AMEN1
SCHEMBL4600010 0.87 LDHA (0.47) LDHAKMT2AFPR2
SCHEMBL30510242 0.87 LDHA (0.47) LDHAKMT2AFPR2
SCHEMBL4183822 0.86 PIN1 (0.36) LDHAMMP1
SCHEMBL25183036 0.86 RAB9A (0.43) MMP1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1641795-B1 TRIAZA- AND TETRAAZA-ANTHRACENEDIONE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS SANOFI AVENTIS DEUTSCHLAND (DE) 2011-03-09 — — EP disclosed
US-7132536-B2 Triaza- and tetraaza-anthracenedione derivatives, their preparation and their use as pharmaceuticals SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2006-11-07 — — US disclosed
EP-1641795-A1 TRIAZA- AND TETRAAZA-ANTHRACENEDIONE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS Sanofi-Aventis Deutschland GmbH (DE) 2006-04-05 — — EP disclosed
US-20040248900-A1 Triaza- and tetraaza-anthracenedione derivatives, their preparation and their use as pharmaceuticals AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-12-09 — — US disclosed
WO-2004094425-A1 Triaza- and tetraaza-anthracenedione derivatives, their preparation and their use as pharmaceuticals SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2004-11-04 — — WO disclosed
EP-1471066-A1 Triaza- and tetraaza-anthracenedione derivates, their preparation and their use as pharmaceuticals Aventis Pharma Deutschland GmbH (DE) 2004-10-27 — — EP 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-20040248900-A1 Triaza- and tetraaza-anthracenedione derivatives, their preparation and their use as pharmaceuticals CYP19A1, TBXAS1, CYP11B1 LDHA 2225/4885MMP1 1031/4885KMT2A 2703/4885

“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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