SCHEMBL6613150

SCHEMBL6613150

CC(=C1Cc2ccc(O)c(O)c2O1)c1cccc(O)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 1/20 0.35
FASN P49327 1/20 0.35
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
POLB P06746 1/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
HSD17B1 P14061 3/20 0.33
HSD17B2 P37059 2/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA6 P23280 1/20 0.33
CA9 Q16790 1/20 0.33
KDM4E B2RXH2 2/20 0.32
GAA P10253 1/20 0.32
PARP1 P09874 1/20 0.32
CTNNB1 P35222 1/20 0.32
EGLN2 Q96KS0 1/20 0.30
CLK1 P49759 1/20 0.30

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
SCHEMBL6616962 0.83 MAPKAPK2 (0.35) MAPKAPK2ALDH1A1MAPTPTGS1PTGS2
SCHEMBL6809593 0.69 TYR (0.45)
SCHEMBL6612263 0.69 TYR (0.45)
SCHEMBL1645904 0.64 MAPKAPK2 (0.42) MAPKAPK2POLBPTGS1PTGS2
SCHEMBL11477205 0.62 PSMB5 (0.43) MAPKAPK2
SCHEMBL2486233 0.60 CA12 (0.56) FASNALDH1A1MAPTHSD17B1HSD17B2
SCHEMBL2486236 0.60 CA12 (0.56) FASNALDH1A1MAPTHSD17B1HSD17B2
SCHEMBL13339140 0.60 CA12 (0.56) FASNALDH1A1MAPTHSD17B1HSD17B2
Resorcinol SCHEMBL11729351 0.60 ALDH1A1 (0.71) FASNALDH1A1HSD17B1HSD17B2CA12
SCHEMBL28993746 0.59 CA12 (0.60) FASNALDH1A1MAPTHSD17B1HSD17B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1381359-A1 AURONES AS TELOMERASE INHIBITORS Pharmacia Italia S.p.A. (IT) 2004-01-21 EP disclosed
WO-2002083123-A1 AURONES AS TELOMERASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2002-10-24 WO disclosed