SCHEMBL5741848

SCHEMBL5741848

O=C(On1nnc2ccccc21)c1cc(O)c(O)c(O)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 5/20 0.68
HDAC4 P56524 5/20 0.68
HDAC1 Q13547 5/20 0.68
HDAC7 Q8WUI4 5/20 0.68
HDAC2 Q92769 5/20 0.68
HDAC10 Q969S8 5/20 0.68
HDAC11 Q96DB2 5/20 0.68
HDAC8 Q9BY41 5/20 0.68
HDAC6 Q9UBN7 5/20 0.68
HDAC9 Q9UKV0 5/20 0.68
HDAC5 Q9UQL6 5/20 0.68
SIRT2 Q8IXJ6 4/20 0.62
SIRT1 Q96EB6 1/20 0.49
SIRT3 Q9NTG7 1/20 0.49
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
SERPINE1 P05121 1/20 0.45
NSD2 O96028 1/20 0.44
KCNMA1 Q12791 2/20 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
SCHEMBL31307068 0.88 HDAC3 (0.64) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL69679 0.84 HDAC3 (0.69) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL1779820 0.84 HDAC3 (0.74) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL10592503 0.80 SIRT2 (0.62) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL12430571 0.80 HDAC3 (0.73) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL11234991 0.80 SIRT2 (0.58) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL69680 0.80 HDAC3 (0.63) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL8641265 0.79 SIRT2 (0.68) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL13604182 0.79 HDAC3 (1.00) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL7413562 0.79 HDAC3 (0.71) HDAC3HDAC4HDAC1HDAC7HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1381663-B1 CLEANING COMPOSITIONS ESC INC (US) 2006-06-14 EP disclosed
US-6851432-B2 Aqueous cleaning composition comprising an alkanolamine, a tetraalkylammonium hydroxide, nonmetallic fluoride salt, a corrosion inhibitor, e.g. ascorbic acid or its derivatives alone or in combination, balance water for removal of ADVANCED TECHNOLOGY MATERIALS, INC. (US) 2005-02-08 US disclosed
EP-1381663-A1 CLEANING COMPOSITIONS ESC Inc. (US) 2004-01-21 EP disclosed
US-20030207777-A1 Cleaning compositions MORGAN STANLEY SENIOR FUNDING, INC. 2003-11-06 US disclosed
US-6627587-B2 Mixture of alkanolamine, tetraalktlammonium hydroxide, fluoride compound and corrosion inhbitor ESC INC. 2003-09-30 US disclosed
US-20030017962-A1 Cleaning compositions ESC, INC 2003-01-23 US disclosed
WO-2002086045-A1 CLEANING COMPOSITIONS ESC, INC. (US) 2002-10-31 WO disclosed