SCHEMBL4424977

SCHEMBL4424977

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

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 10/20 0.43
▸ ALDH1A1 P00352 2/20 0.40
▸ KCNH2 Q12809 1/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ CYP3A4 P08684 1/20 0.38
▸ SLC6A2 P23975 1/20 0.38
▸ SLC6A4 P31645 1/20 0.38
▸ AOC3 Q16853 1/20 0.38
▸ CNR2 P34972 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ ACP3 P15309 1/20 0.36

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
SCHEMBL17928455 0.78 KIF11 (0.46) KIF11ALDH1A1KCNH2KMT2A
SCHEMBL3696872 0.76 SLC6A1 (0.43) KIF11SLC6A2SLC6A4AOC3
SCHEMBL8072121 0.74 SMN1; SMN2 (0.41) KIF11ALDH1A1MAPK1MEN1KMT2A
SCHEMBL20371123 0.71 KIF11 (0.51) KIF11KCNH2SLC6A2SLC6A4
SCHEMBL715992 0.71 KIF11 (0.50) KIF11KCNH2
SCHEMBL10590754 0.70 AOC3 (0.54) ALDH1A1TDP1MAPK1L3MBTL1SLC6A2
SCHEMBL20371105 0.70 KIF11 (0.53) KIF11KCNH2SLC6A4KMT2A
SCHEMBL9508740 0.70 KIF11 (0.49) KIF11KCNH2MEN1KMT2A
SCHEMBL9860176 0.70 MEN1 (0.46) KIF11KCNH2MEN1KMT2AACP3
SCHEMBL17173364 0.69 CA4 (0.46) KIF11ALDH1A1KCNH2KMT2A

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-2081949-A2 TRIPARTITE OLIGONUCLEOTIDE COMPLEXES AND METHODS FOR GENE SILENCING BY RNA INTERFERENCE Dharmacon, Inc. (US) 2009-07-29 — — EP disclosed
EP-2064223-A2 DUPLEX OLIGONUCLEOTIDE COMPLEXES AND METHODS FOR GENE SILENCING BY RNA INTERFERENCE Dharmacon, Inc. (US) 2009-06-03 — — EP disclosed
WO-2008036841-A2 TRIPARTITE OLIGONUCLEOTIDE COMPLEXES AND METHODS FOR GENE SILENCING BY RNA INTERFERENCE DHARMACON, INC. (US) 2008-03-27 — — WO disclosed
WO-2008036825-A2 DUPLEX OLIGONUCLEOTIDE COMPLEXES AND METHODS FOR GENE SILENCING BY RNA INTERFERENCE DHARMACON, INC. (US) 2008-03-27 — — WO disclosed
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