SCHEMBL14878516

SCHEMBL14878516

CC[C@H](O)C[C@@H](COC(c1ccccc1)(c1ccc(OC)cc1)c1ccc(OC)cc1)NC(=O)OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 1/20 0.50
▸ CTSK P43235 4/20 0.46
▸ CTSL P07711 3/20 0.46
▸ CTSS P25774 2/20 0.46
▸ SYK P43405 1/20 0.45
▸ ITGB3 P05106 1/20 0.43
▸ ITGA2B P08514 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ CA1 P00915 1/20 0.42
▸ CA2 P00918 1/20 0.42
▸ ACHE P22303 1/20 0.42
▸ CTRB1 P17538 2/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.41
▸ PLAU P00749 1/20 0.41
▸ CTSD P07339 1/20 0.41
▸ F2 P00734 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
SCHEMBL14878519 0.84 SYK (0.42) ATMCTSKCTSLCTSSSYK
SCHEMBL13032794 0.78 HDAC6 (0.47) ATMSYKHDAC8
SCHEMBL14370507 0.77 ATM (0.62) ATMCTSKCTSLCTSSSYK
SCHEMBL7616339 0.77 MEN1 (0.44) ATMCTSKCTSLCTSSALDH1A1
SCHEMBL14878522 0.77 SYK (0.55) ATMCTSKCTSLCTSSSYK
SCHEMBL3700787 0.77 L3MBTL1 (0.47) ATMCTSKCTSLCTSSALDH1A1
SCHEMBL6419856 0.76 MEN1 (0.44) ATMCTSKCTSLCTSSITGB3
SCHEMBL6856061 0.74 MDM2 (0.46) KMT2A
SCHEMBL8717149 0.73 CA1 (0.53) ALDH1A1CA1CA2MEN1KMT2A
SCHEMBL6419860 0.72 ATM (0.47) ATMCTSKCTSLCTSSALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9476045-B2 iRNA agents with biocleavable tethers ALNYLAM PHARMACEUTICALS, INC. (US) 2016-10-25 — — US disclosed
US-20150073133-A1 iRNA AGENTS WITH BIOCLEAVABLE TETHERS BANK OF AMERICA, N.A. 2015-03-12 — — US disclosed
US-8865677-B2 iRNA agents with biocleavable tethers ALNYLAM PHARMACEUTICALS, INC. (US) 2014-10-21 — — US disclosed
US-20130281685-A1 iRNA AGENTS WITH BIOCLEAVABLE TETHERS BANK OF AMERICA, N.A. 2013-10-24 — — US disclosed
US-8426377-B2 iRNA agents with biocleavable tethers ALNYLAM PHARMACEUTICALS, INC. (US) 2013-04-23 — — US disclosed
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