SCHEMBL6682499

SCHEMBL6682499

COc1ccc([C](c2ccccc2)c2ccc(C(c3ccccc3)(c3ccccc3)c3ccccc3)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.55
CES1 P23141 1/20 0.55
MAPT P10636 3/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
KCNK9 Q9NPC2 1/20 0.46
ALDH1A1 P00352 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
LMNA P02545 1/20 0.46
ALOX15 P16050 1/20 0.46
APEX1 P27695 1/20 0.46
MAPK1 P28482 1/20 0.46
RECQL P46063 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
KIF11 P52732 2/20 0.45
KDM4E B2RXH2 1/20 0.45
GAA P10253 1/20 0.45

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
SCHEMBL14856629 1.00 CES2 (0.55) CES2CES1MAPTNPC1RAB9A
SCHEMBL719395 1.00 CES2 (0.55) CES2CES1MAPTNPC1RAB9A
SCHEMBL2761265 1.00 CES2 (0.55) CES2CES1MAPTNPC1RAB9A
SCHEMBL8823207 1.00 CES2 (0.55) CES2CES1MAPTNPC1RAB9A
SCHEMBL10762267 0.98 CES2 (0.52) CES2CES1MAPTNPC1RAB9A
SCHEMBL8648263 0.91 MAPT (0.55) CES2CES1MAPTNPC1RAB9A
SCHEMBL7953 0.87 CES2 (0.69) CES2CES1MAPTNPC1RAB9A
SCHEMBL9102 0.87 CES2 (0.69) CES2CES1MAPTNPC1RAB9A
SCHEMBL28067932 0.87 CA4 (0.59) CES2CES1MAPTNPC1RAB9A
SCHEMBL10112758 0.87 CA4 (0.59) CES2CES1MAPTNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1474432-A1 IMMUNOSTIMULATORY, COVALENTLY LIPIDATED OLIGONUCLEOTIDES Biomira Inc. (CA) 2004-11-10 EP disclosed
WO-2003066649-A1 IMMUNOSTIMULATORY, COVALENTLY LIPIDATED OLIGONUCLEOTIDES BIOMIRA INC. (CA) 2003-08-14 WO disclosed
US-5565449-A PLATELET AGGREGATION INHIBITORS GENENTECH, INC. (US) 1996-10-15 US disclosed
EP-0191659-A1 Derivatives of adenosine nucleosides, their preparation and their biological use INSTITUT PASTEUR (FR) 1986-08-20 EP disclosed
EP-0124561-A1 PROCESS FOR PRODUCING OLIGONUCLEOSIDE PHOSPHONATES. KOSTER HUBERT 1984-11-14 EP disclosed
WO-1984001778-A1 PROCESS FOR PRODUCING OLIGONUCLEOSIDE PHOSPHONATES KOESTER HUBERT (DE) 1984-05-10 WO disclosed