SCHEMBL4428708

SCHEMBL4428708

COc1ccc(C(OC(CCO)C2CCNCC2)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 2/20 0.41
▸ SLC6A4 P31645 2/20 0.41
▸ KIF11 P52732 6/20 0.40
▸ SLC6A1 P30531 2/20 0.39
▸ SLC6A11 P48066 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.38
▸ MMP1 P03956 1/20 0.38
▸ MMP2 P08253 1/20 0.38
▸ MMP3 P08254 1/20 0.38
▸ MMP7 P09237 1/20 0.38
▸ MMP9 P14780 1/20 0.38
▸ MMP8 P22894 1/20 0.38
▸ MMP13 P45452 1/20 0.38
▸ KCNH2 Q12809 1/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ LMNA P02545 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35

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
SCHEMBL4432581 0.82 SLC6A3 (0.43) SLC6A2SLC6A4KIF11SLC6A1SLC6A11
SCHEMBL3693600 0.77 SLC6A11 (0.48) SLC6A2SLC6A4KIF11SLC6A1SLC6A11
SCHEMBL17928455 0.75 KIF11 (0.46) KIF11SLC6A1SLC6A11KCNH2KMT2A
SCHEMBL27352091 0.70 LMNA (0.73) KIF11TDP1KCNH2MEN1KMT2A
Hydrochloric Acid SCHEMBL11614531 0.70 SLC6A2 (0.48) SLC6A2SLC6A4KIF11TDP1KCNH2
SCHEMBL17173364 0.70 CA4 (0.46) KIF11KCNH2KMT2AALDH1A1
SCHEMBL21562153 0.70 CA4 (0.46) KIF11KCNH2KMT2AALDH1A1
SCHEMBL4424977 0.68 KIF11 (0.43) SLC6A2SLC6A4KIF11TDP1KCNH2
SCHEMBL715992 0.68 KIF11 (0.50) KIF11KCNH2SMN1; SMN2LMNA
SCHEMBL12613814 0.67 SLC6A11 (0.47) KIF11SLC6A1SLC6A11TDP1KCNH2

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-2008036825-A2 DUPLEX OLIGONUCLEOTIDE COMPLEXES AND METHODS FOR GENE SILENCING BY RNA INTERFERENCE DHARMACON, INC. (US) 2008-03-27 — — WO disclosed
WO-2008036841-A2 TRIPARTITE OLIGONUCLEOTIDE COMPLEXES AND METHODS FOR GENE SILENCING BY RNA INTERFERENCE DHARMACON, INC. (US) 2008-03-27 — — WO disclosed
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