SCHEMBL4445249

SCHEMBL4445249

C=C(C(=O)OCC)C1=NCCO1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.36
TSHR P16473 2/20 0.36
ATM Q13315 1/20 0.36
MAPT P10636 2/20 0.34
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC10 Q969S8 1/20 0.33
HDAC11 Q96DB2 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC9 Q9UKV0 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
POLB P06746 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
ALPL P05186 1/20 0.30

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
SCHEMBL4453599 0.88 HDAC3 (0.34) ALDH1A1TSHRHDAC3HDAC4HDAC1
SCHEMBL28719756 0.80 HDAC3 (0.36) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL27532139 0.80 PDE4D (0.41) ALDH1A1TSHRMAPTHDAC3HDAC4
SCHEMBL12799682 0.74 HDAC3 (0.35) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL27740689 0.73 HDAC3 (0.35) MAPTHDAC3HDAC4HDAC1HDAC7
SCHEMBL27760002 0.71
SCHEMBL24105116 0.70 MAPT (0.36) ALDH1A1TSHRMAPTSMN1; SMN2NPC1
SCHEMBL29232743 0.68 HDAC3 (0.47) ALDH1A1TSHRHDAC3HDAC4HDAC1
SCHEMBL11126797 0.67 HTT (0.41) ALDH1A1MAPTHDAC3HDAC4HDAC1
SCHEMBL28703109 0.67 HDAC3 (0.36) 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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1474454-B1 THERMOSETTING COMPOSITIONS CONTAINING ALTERNATING COPOLYMERS OF ISOBUTYLENE TYPE MONOMERS PPG IND OHIO INC (US) 2009-11-18 EP claimed
JP-4219277-B2 2009-02-04 JP claimed
EP-1474479-B1 POWDER COATING COMPOSITIONS HAVING IMPROVED MAR AND ACID RESISTANCE PPG IND OHIO INC (US) 2008-08-06 EP claimed
JP-3993563-B2 2007-10-17 JP claimed
EP-1786872-A1 POWDER COATING COMPOSITIONS PPG Industries Ohio, Inc. (US) 2007-05-23 EP claimed
US-7166675-B2 Low gloss powder coating composition PPG INDUSTRIES OHIO, INC. (US) 2007-01-23 US claimed
US-7132477-B2 Powder coating compositions PPG INDUSTRIES OHIO, INC. (US) 2006-11-07 US claimed
WO-2006026492-A1 POWDER COATING COMPOSITIONS PPG INDUSTRIES OHIO, INC. (US) 2006-03-09 WO claimed
JP-2005517775-A 2005-06-16 JP claimed
JP-2005517790-A 2005-06-16 JP claimed
US-20050025987-A1 Powder coating compositions PPG INDUSTRIES OHIO INC. 2005-02-03 US claimed
EP-1474479-A2 POWDER COATING COMPOSITIONS HAVING IMPROVED MAR AND ACID RESISTANCE PPG Industries Ohio, Inc. (US) 2004-11-10 EP claimed
EP-1474454-A1 THERMOSETTING COMPOSITIONS CONTAINING ALTERNATING COPOLYMERS OF ISOBUTYLENE TYPE MONOMERS PPG Industries Ohio, Inc. (US) 2004-11-10 EP claimed
US-20040186242-A1 Low gloss powder coating composition PPG INDUSTRIES OHIO, INC. 2004-09-23 US claimed
US-20030171497-A1 Thermosetting compositions containing alternating copolymers of isobutylene type monomers PPG INDUSTRIES OHIO, INC. 2003-09-11 US claimed
US-20030166787-A1 Powder coating compositions having improved mar and acid resistance PPG INDUSTRIES OHIO, INC. 2003-09-04 US claimed
WO-2003070826-A2 POWDER COATING COMPOSITIONS HAVING IMPROVED MAR AND ACID RESISTANCE PPG INDUSTRIES OHIO, INC. (US) 2003-08-28 WO claimed
WO-2003070781-A1 THERMOSETTING COMPOSITIONS CONTAINING ALTERNATING COPOLYMERS OF ISOBUTYLENE TYPE MONOMERS PPG INDUSTRIES OHIO, INC. (US) 2003-08-28 WO claimed
EP-1474479-B1 POWDER COATING COMPOSITIONS HAVING IMPROVED MAR AND ACID RESISTANCE PPG IND OHIO INC (US) 2008-08-06 EP disclosed
WO-2003070826-A2 POWDER COATING COMPOSITIONS HAVING IMPROVED MAR AND ACID RESISTANCE PPG INDUSTRIES OHIO, INC. (US) 2003-08-28 WO disclosed