SCHEMBL4430315

SCHEMBL4430315

COc1ccc(C(OC(O)CCc2ccc(NC(=O)OCc3ccccc3)cc2)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 2/20 0.48
▸ ALDH1A1 P00352 4/20 0.47
▸ TP53 P04637 2/20 0.47
▸ MAPT P10636 2/20 0.47
▸ LMNA P02545 2/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ ATM Q13315 1/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ HDAC2 Q92769 2/20 0.45
▸ POLB P06746 2/20 0.44
▸ FPR2 P25090 1/20 0.43
▸ HDAC3 O15379 1/20 0.43
▸ HDAC4 P56524 1/20 0.43
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC7 Q8WUI4 1/20 0.43
▸ HDAC10 Q969S8 1/20 0.43

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
SCHEMBL3693004 0.81 CA1 (0.46) HDAC8ALDH1A1TP53MAPTLMNA
SCHEMBL1223807 0.80 RAB9A (0.67) HDAC8ALDH1A1TP53MAPTLMNA
SCHEMBL11813314 0.78 TP53 (0.68) ALDH1A1TP53MAPTLMNASMN1; SMN2
SCHEMBL6743384 0.77 MAPT (0.62) HDAC8ALDH1A1TP53MAPTLMNA
SCHEMBL8867357 0.75 ALDH1A1 (0.55) ALDH1A1TP53MAPTLMNASMN1; SMN2
SCHEMBL8867363 0.75 ALDH1A1 (0.55) ALDH1A1TP53MAPTLMNASMN1; SMN2
SCHEMBL3034797 0.73 MIF (0.60) ALDH1A1TP53MAPTLMNASMN1; SMN2
SCHEMBL9800498 0.73 FPR2 (0.65) HDAC8ALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL23483449 0.72 SMN1; SMN2 (0.75) ALDH1A1TP53MAPTSMN1; SMN2RAB9A
SCHEMBL590420 0.72 POLB (0.62) ALDH1A1TP53MAPTSMN1; SMN2RAB9A

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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