SCHEMBL9818658

SCHEMBL9818658

COc1ccc(OC)c(NC(=O)NCC2(c3ccccc3)CCCCC2)c1

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.69
KMT2A Q03164 7/20 0.67
MEN1 O00255 6/20 0.67
ALDH1A1 P00352 3/20 0.60
L3MBTL1 Q9Y468 2/20 0.57
GAA P10253 1/20 0.53
P2RX7 Q99572 1/20 0.52

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
SCHEMBL9818694 0.83 CNR1 (0.62) MAPTKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL9818712 0.82 ALDH1A1 (0.69) MAPTKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL9818610 0.77 TP53 (0.79) MAPTKMT2AMEN1L3MBTL1
SCHEMBL9818742 0.75 TP53 (0.62) MAPTKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL10073037 0.75 MEN1 (0.84) KMT2AMEN1ALDH1A1L3MBTL1GAA
SCHEMBL9818726 0.75 TP53 (0.62) MAPTKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL3904049 0.75 MEN1 (0.97) KMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL9818724 0.75 CNR1 (0.63) MAPTKMT2AMEN1ALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL2891114 0.74 MEN1 (0.53) MAPTKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL9818668 0.74 CNR1 (0.70) KMT2AMEN1ALDH1A1L3MBTL1

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
US-5015644-A Antihyperlipidemic and antiatherosclerotic urea and carbamate compounds WARNER-LAMBERT COMPANY (US) 1991-05-14 US disclosed