SCHEMBL806274

SCHEMBL806274

COc1ccc(N(c2ccc(C)cc2)c2ccc(Cc3ccc(N(c4ccc(CO)cc4)c4ccc(CO)cc4)cc3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.47
ACHE P22303 1/20 0.47
ALOX5 P09917 1/20 0.44
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43
SAE1 Q9UBE0 1/20 0.43
UBA2 Q9UBT2 1/20 0.43
ALDH1A1 P00352 2/20 0.42
LMNA P02545 2/20 0.42
TP53 P04637 1/20 0.42
HPGD P15428 1/20 0.42
MAPT P10636 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.40
TSPO P30536 1/20 0.40
IDH1 O75874 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
OPRM1 P35372 1/20 0.40
RELA Q04206 1/20 0.40

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
SCHEMBL19888131 0.95 ACHE (0.52) ACHECNR1CNR2ALDH1A1LMNA
SCHEMBL19888139 0.95 ACHE (0.52) ACHECNR1CNR2ALDH1A1LMNA
SCHEMBL12593370 0.95 ACHE (0.52) ACHECNR1CNR2ALDH1A1LMNA
SCHEMBL9892953 0.94 LTA4H (0.53) LTA4HSAE1UBA2ALDH1A1LMNA
SCHEMBL12680473 0.91 ACHE (0.47) ACHEALOX5CNR1CNR2MAPT
SCHEMBL13883995 0.91 ACHE (0.47) ACHEALOX5CNR1CNR2MAPT
SCHEMBL806368 0.91 LTA4H (0.47) LTA4HACHECNR1CNR2ALDH1A1
SCHEMBL13236086 0.91 ACHE (0.47) ACHEALOX5CNR1CNR2MAPT
SCHEMBL13884019 0.89 LTA4H (0.49) LTA4HALOX5SAE1UBA2TP53
SCHEMBL11890477 0.89 LTA4H (0.49) LTA4HALOX5SAE1UBA2LMNA

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-2012036295-A1 ELECTROPHOTOGRAPHIC PHOTOCONDUCTOR, IMAGE FORMING METHOD, IMAGE FORMING APPARATUS, AND PROCESS CARTRIDGE RICOH COMPANY, LTD. (JP) 2012-03-22 WO disclosed