SCHEMBL13785541

SCHEMBL13785541

C=C(C)C(=O)OCCOC(=O)c1cc(C(=O)OCCOC(=O)C(=C)C)c(C(=O)Nc2ccc(Oc3ccc(NC)cc3)cc2)cc1C(C)=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ PNLIP P16233 5/20 0.37
▸ LMNA P02545 1/20 0.37
▸ MAPK1 P28482 2/20 0.37
▸ MAPT P10636 1/20 0.37
▸ GFER P55789 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ BRAF P15056 3/20 0.35
▸ HDAC1 Q13547 3/20 0.35
▸ HDAC3 O15379 2/20 0.35
▸ HDAC4 P56524 2/20 0.35
▸ HDAC7 Q8WUI4 2/20 0.35
▸ HDAC2 Q92769 2/20 0.35
▸ HDAC10 Q969S8 2/20 0.35
▸ HDAC11 Q96DB2 2/20 0.35
▸ HDAC8 Q9BY41 2/20 0.35
▸ HDAC6 Q9UBN7 2/20 0.35
▸ HDAC9 Q9UKV0 2/20 0.35
▸ HDAC5 Q9UQL6 2/20 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
SCHEMBL20464771 0.94 PNLIP (0.37) MEN1KMT2APNLIPLMNAMAPK1
SCHEMBL19795530 0.94 TDP1 (0.39) MEN1KMT2APNLIPLMNAMAPK1
SCHEMBL19795542 0.92 MEN1 (0.36) MEN1KMT2APNLIPLMNAMAPK1
SCHEMBL16978024 0.92 MAPK1 (0.40) MEN1KMT2APNLIPLMNAMAPK1
SCHEMBL20464772 0.80 KDM4E (0.36) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL19320455 0.79 THRB (0.49) KMT2AMAPK1MAPTL3MBTL1ALDH1A1
SCHEMBL20467901 0.79 BRAF (0.38) MEN1KMT2APNLIPLMNAMAPK1
SCHEMBL12539660 0.78 MEN1 (0.53) MEN1KMT2APNLIPLMNAMAPK1
SCHEMBL19478030 0.77 BRAF (0.41) MEN1KMT2APNLIPLMNAMAPK1
SCHEMBL22446466 0.77 TDP1 (0.38) MEN1KMT2ALMNAMAPK1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7561244-B2 Liquid-filled composite with supporting members covalenty bonded to the substrates KONINKLIJKE PHILIPS ELECTRONICS N.V. (NL) 2009-07-14 — — US disclosed
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