SCHEMBL8701246

SCHEMBL8701246

O=C(CCN1CCCC1)Nc1ccc2cc3cc(NC(=O)CCN4CCCC4)ccc3cc2c1

nearest known ligand 0.78

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TERT O14746 11/20 0.78
MAPK1 P28482 1/20 0.67
ALDH1A1 P00352 4/20 0.65
MAPT P10636 2/20 0.65
SMN1; SMN2 Q16637 1/20 0.63
ALOX15 P16050 1/20 0.63
KMT2A Q03164 2/20 0.62
POLB P06746 1/20 0.62
LMNA P02545 1/20 0.62
MEN1 O00255 1/20 0.62

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
SCHEMBL9630612 0.89 LMNA (0.70) TERTALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL13989207 0.87 TERT (1.00) TERT
SCHEMBL3116872 0.86 TERT (1.00) TERT
SCHEMBL19300319 0.80 TP53 (0.78) TERTMAPK1ALDH1A1MAPTSMN1; SMN2
SCHEMBL4298492 0.80 TERT (1.00) TERTMAPK1ALDH1A1MAPTSMN1; SMN2
SCHEMBL8704683 0.80 TERT (1.00) TERTMAPK1ALDH1A1MAPTSMN1; SMN2
SCHEMBL8706042 0.79 TERT (1.00) TERTMAPK1ALDH1A1MAPT
SCHEMBL4300594 0.79 TERT (1.00) TERTMAPK1ALDH1A1MAPT
SCHEMBL3115635 0.79 TERT (1.00) TERTMAPK1ALDH1A1MAPT
SCHEMBL8706439 0.79 TERT (1.00) TERTMAPK1ALDH1A1MAPT

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