SCHEMBL6867482

SCHEMBL6867482

COc1ccc2c(c1)cc(C(O)c1cc3ccccc3n1S(=O)(=O)c1ccccc1)n2S(=O)(=O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.58
HTR6 P50406 8/20 0.57
POLB P06746 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
HDAC1 Q13547 4/20 0.52
HDAC6 Q9UBN7 4/20 0.52
HDAC3 O15379 3/20 0.52
HDAC4 P56524 3/20 0.52
HDAC7 Q8WUI4 3/20 0.52
HDAC2 Q92769 3/20 0.52
HDAC10 Q969S8 3/20 0.52
HDAC11 Q96DB2 3/20 0.52
HDAC8 Q9BY41 3/20 0.52
HDAC9 Q9UKV0 3/20 0.52
HDAC5 Q9UQL6 3/20 0.52
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
ACLY P53396 1/20 0.45
CXCL8 P10145 1/20 0.44
NOD1 Q9Y239 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
SCHEMBL6866228 0.96 HTR6 (0.57) RECQLHTR6POLBL3MBTL1HDAC1
SCHEMBL6860277 0.93 RECQL (0.58) RECQLHTR6POLBL3MBTL1HDAC1
SCHEMBL6860250 0.88 HTR6 (0.47) RECQLHTR6POLBL3MBTL1HDAC1
SCHEMBL6866858 0.86 HTR6 (0.47) RECQLHTR6POLBL3MBTL1HDAC1
SCHEMBL6864332 0.86 RECQL (0.73) RECQLHTR6HDAC1HDAC6HDAC3
SCHEMBL6866844 0.85 HTR6 (0.47) RECQLHTR6POLBL3MBTL1HDAC1
SCHEMBL17927513 0.84 HTR6 (0.69) RECQLHTR6POLBL3MBTL1HDAC1
SCHEMBL5716666 0.83 RECQL (0.51) RECQLHTR6POLBL3MBTL1HDAC1
SCHEMBL5716696 0.83 HDAC3 (0.47) RECQLHTR6POLBL3MBTL1HDAC1
SCHEMBL6865379 0.83 HDAC3 (0.66) HTR6POLBL3MBTL1HDAC1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6812243-B2 AS TYROSINE KINASE INHIBITORS; FOR THERARPY OF TUMORS, ARTERIOSCLEROSIS, RESTENOSIS AFTER BALLOON ANGIOPLASTY, ARTHRITIS AND FIBROTIC DISEASES ZENTARIS AG (DE) 2004-11-02 US disclosed
US-20030008898-A1 Indole derivatives and their use for the treatment of malignant and other diseases based on pathological proliferation ZENTARIS AG (DE) 2003-01-09 US disclosed
EP-1109785-B1 INDOLE DERIVATIVES AND THEIR USE IN THE TREATMENT OF MALIGNANT AND OTHER DISEASES CAUSED BY PATHOLOGICAL CELL PROLIFERATION ZENTARIS AG (DE) 2003-01-02 EP disclosed
US-6407102-B1 TYROSINE KINASE AND PLATELET-DERIVED GROWTH FACTOR INHIBITORS; ANTICARCINOGENIC, ANTITUMOR, ANTIARTHRITIC AND ANTIPROLIFERATIVE AGENTS; RESTENOSIS, ARTERIOSCLEROSIS ZENTARIS AG (DE) 2002-06-18 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-20030008898-A1 Indole derivatives and their use for the treatment of malignant and other diseases based on pathological proliferation MKI67, IDO1, CCNI RECQL 3640/4885HTR6 265/4885POLB 2321/4885

“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.