SCHEMBL4582870

SCHEMBL4582870

O=C(C=C1c2ccccc2C(=O)c2ccccc21)c1ccc(O)c(O)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAP3K7 O43318 1/20 0.64
TAB1 Q15750 1/20 0.64
BCL2 P10415 1/20 0.50
MCL1 Q07820 1/20 0.50
LCK P06239 1/20 0.50
SNCA P37840 2/20 0.45
TERT O14746 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL4779180 0.89 MAP3K7 (0.54) MAP3K7TAB1BCL2MCL1LCK
SCHEMBL4779176 0.89 MAP3K7 (0.54) MAP3K7TAB1BCL2MCL1LCK
SCHEMBL4795882 0.89 MAP3K7 (0.56) MAP3K7TAB1LCKMAPT
SCHEMBL4779169 0.88 MAP3K7 (0.60) MAP3K7TAB1SNCATERTMAPT
SCHEMBL4979980 0.87 MAP3K7 (0.50) MAP3K7TAB1BCL2MCL1
SCHEMBL14273443 0.87 MAP3K7 (0.50) MAP3K7TAB1BCL2MCL1
SCHEMBL4726277 0.86 MAP3K7 (0.59) MAP3K7TAB1SNCATERTMAPT
SCHEMBL4982661 0.84 MAP3K7 (0.54) MAP3K7TAB1LCK
SCHEMBL4982657 0.84 MAP3K7 (0.54) MAP3K7TAB1LCK
SCHEMBL4981501 0.82 MMP9 (0.47) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1897864-A1 Anthracene derivatives and the use thereof for treating benign and malignant tumors AEterna Zentaris GmbH (DE) 2008-03-12 EP claimed
US-20080051463-A1 ANTHRACENE COMPOUNDS AND THEIR USE FOR TREATING BENIGN AND MALIGNANT TUMOR DISORDERS AETERNA ZENTARIS GMBH (DE) 2008-02-28 US claimed
EP-1897864-A1 Anthracene derivatives and the use thereof for treating benign and malignant tumors AEterna Zentaris GmbH (DE) 2008-03-12 EP disclosed
EP-1897864-A1 Anthracene derivatives and the use thereof for treating benign and malignant tumors AEterna Zentaris GmbH (DE) 2008-03-12 EP disclosed
EP-1897864-A1 Anthracene derivatives and the use thereof for treating benign and malignant tumors AEterna Zentaris GmbH (DE) 2008-03-12 EP disclosed
US-20080051463-A1 ANTHRACENE COMPOUNDS AND THEIR USE FOR TREATING BENIGN AND MALIGNANT TUMOR DISORDERS AETERNA ZENTARIS GMBH (DE) 2008-02-28 US disclosed
US-20080051463-A1 ANTHRACENE COMPOUNDS AND THEIR USE FOR TREATING BENIGN AND MALIGNANT TUMOR DISORDERS AETERNA ZENTARIS GMBH (DE) 2008-02-28 US disclosed
US-20080051463-A1 ANTHRACENE COMPOUNDS AND THEIR USE FOR TREATING BENIGN AND MALIGNANT TUMOR DISORDERS AETERNA ZENTARIS GMBH (DE) 2008-02-28 US disclosed
WO-2008015265-A1 ANTHRACEN DERIVATIVES AND THEIR USE FOR THE TREATMENT OF BENIGN AND MALIGNANT TUMOROUS DISEASES ÆTERNA ZENTARIS GMBH (DE) 2008-02-07 WO disclosed
WO-2008015265-A1 ANTHRACEN DERIVATIVES AND THEIR USE FOR THE TREATMENT OF BENIGN AND MALIGNANT TUMOROUS DISEASES ÆTERNA ZENTARIS GMBH (DE) 2008-02-07 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-20080051463-A1 ANTHRACENE COMPOUNDS AND THEIR USE FOR TREATING BENIGN AND MALIGNANT TUMOR DISORDERS TUBB1, TUBA1C, TUBB3 MAP3K7 1090/4885TAB1 981/4885BCL2 542/4885

“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.