SCHEMBL7924524

SCHEMBL7924524

COc1ccc(C(OC(O)C(C)N)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 11/20 0.47
KCNH2 Q12809 1/20 0.43
CA4 P22748 1/20 0.38
KMT2A Q03164 2/20 0.38
LTA4H P09960 1/20 0.38
CYP2D6 P10635 1/20 0.38
ADRA2A P08913 1/20 0.38
ADRA1A P35348 1/20 0.38
MEN1 O00255 1/20 0.37
MAPK1 P28482 1/20 0.37
BLM P54132 1/20 0.37
SLC6A4 P31645 1/20 0.37

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
SCHEMBL7049682 0.81 KIF11 (0.43) KIF11KCNH2CA4KMT2ALTA4H
SCHEMBL21562153 0.80 CA4 (0.46) KIF11KCNH2CA4KMT2ALTA4H
SCHEMBL17173364 0.80 CA4 (0.46) KIF11KCNH2CA4KMT2ALTA4H
SCHEMBL8934873 0.79 NR3C2 (0.36) KIF11CA4KMT2ACYP2D6ADRA2A
SCHEMBL20371105 0.78 KIF11 (0.53) KIF11KCNH2KMT2ASLC6A4
SCHEMBL28346610 0.78 KIF11 (0.44) KIF11KCNH2CA4KMT2ALTA4H
SCHEMBL4436554 0.77 KIF11 (0.42) KIF11KCNH2CA4KMT2ALTA4H
SCHEMBL4421575 0.76 KIF11 (0.45) KIF11KCNH2KMT2ALTA4HMEN1
SCHEMBL13388489 0.76 KIF11 (0.50) KIF11KCNH2
SCHEMBL7010039 0.75 KMT2A (0.44) KIF11KCNH2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0819134-B1 COVALENTLY CROSS-LINKED OLIGONUCLEOTIDES, METHOD FOR PREPARING SAME, AND SYNTHON USED THEREIN GENSET SA (FR) 2001-07-18 EP disclosed
US-6187913-B1 Covalently crosslinked oligonucleotides, preparation method and synthon which is of use in the method GENSET (FR) 2001-02-13 US disclosed
EP-0819134-A1 COVALENTLY CROSS-LINKED OLIGONUCLEOTIDES, METHOD FOR PREPARING SAME, AND SYNTHON USED THEREIN GENSET SA (FR) 1998-01-21 EP disclosed
WO-1996031523-A1 COVALENTLY CROSS-LINKED OLIGONUCLEOTIDES, METHOD FOR PREPARING SAME, AND SYNTHON USED THEREIN GENSET (FR) 1996-10-10 WO disclosed