SCHEMBL8704683

SCHEMBL8704683

O=C(CCN1CCCC1)Nc1ccc2c(c1)C(=O)c1ccc(NC(=O)CCN3CCCC3)cc1C2=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TERT O14746 17/20 1.00
ALDH1A1 P00352 1/20 0.97
MAPT P10636 1/20 0.97
SMN1; SMN2 Q16637 1/20 0.64
MAPK1 P28482 1/20 0.64

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
SCHEMBL4298492 1.00 TERT (1.00) TERTALDH1A1MAPTSMN1; SMN2MAPK1
SCHEMBL3115635 0.99 TERT (1.00) TERTALDH1A1MAPTMAPK1
SCHEMBL8706439 0.99 TERT (1.00) TERTALDH1A1MAPTMAPK1
SCHEMBL4300594 0.99 TERT (1.00) TERTALDH1A1MAPTMAPK1
SCHEMBL8706042 0.99 TERT (1.00) TERTALDH1A1MAPTMAPK1
Maleic Acid SCHEMBL8701607 0.92 TERT (0.86) TERTALDH1A1MAPTMAPK1
SCHEMBL4293444 0.89 TERT (0.95) TERTALDH1A1MAPT
SCHEMBL9629969 0.89 TERT (1.00) TERTALDH1A1MAPT
SCHEMBL9630665 0.88 TERT (0.79) TERTALDH1A1MAPT
SCHEMBL4302435 0.88 TERT (0.79) TERTALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998025885-A1 ANTHRAQUINONES WITH BIOLOGICAL ACTIVITY CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 1998-06-18 WO disclosed