SCHEMBL213415

SCHEMBL213415

CCCC(CCC)=NOC(C)=O

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
CES1 P23141 3/20 0.39
CES2 O00748 2/20 0.39
HDAC3 O15379 4/20 0.39
HDAC1 Q13547 4/20 0.39
HDAC2 Q92769 4/20 0.39
HDAC8 Q9BY41 4/20 0.39
HDAC6 Q9UBN7 1/20 0.39
FFAR3 O14843 3/20 0.38
HSD17B10 Q99714 2/20 0.36
TSHR P16473 1/20 0.36
LMNA P02545 1/20 0.36
PKM P14618 1/20 0.33
KDM4E B2RXH2 1/20 0.33
CTSD P07339 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
FASN P49327 1/20 0.31

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
SCHEMBL211465 0.91 ALDH1A1 (0.42) ALDH1A1CES1CES2HDAC3HDAC1
SCHEMBL211466 0.91 ALDH1A1 (0.42) ALDH1A1CES1CES2HDAC3HDAC1
SCHEMBL212974 0.89 CES1 (0.43) ALDH1A1CES1CES2HSD17B10TSHR
SCHEMBL17257174 0.84 MEN1 (0.33) ALDH1A1TSHR
SCHEMBL17257176 0.84 MEN1 (0.33) ALDH1A1TSHR
SCHEMBL213904 0.83 HDAC3 (0.42) ALDH1A1CES1CES2HDAC3HDAC1
SCHEMBL213905 0.83 HDAC3 (0.42) ALDH1A1CES1CES2HDAC3HDAC1
SCHEMBL213813 0.82 ALDH1A1 (0.38) ALDH1A1FFAR3HSD17B10TSHRLMNA
SCHEMBL17257076 0.82 TSHR (0.38) CES1TSHR
SCHEMBL17257074 0.82 TSHR (0.38) CES1TSHR

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
US-20120077941-A1 POLYMERS FUNCTIONALIZED WITH PROTECTED OXIME COMPOUNDS BRIDGESTONE CORPORATION (JP) 2012-03-29 US claimed
US-8088868-B2 oximation of cojugated homopolymers formed by addtion polymerization of conjugated diene monomer in the presence lanthanide copmpounds as polymerization catalysts; polymers used in the manufacture of tires having reduced hysteresis BRIDGESTONE CORPORATION (JP) 2012-01-03 US claimed
US-20080146745-A1 POLYMERS FUNCTIONALIZED WITH PROTECTED OXIME COMPOUNDS BRIDGESTONE CORPORATION (JP) 2008-06-19 US claimed
US-8541509-B2 Polymers functionalized with protected oxime compounds BRIDGESTONE CORPORATION (JP) 2013-09-24 US disclosed
US-20120077941-A1 POLYMERS FUNCTIONALIZED WITH PROTECTED OXIME COMPOUNDS BRIDGESTONE CORPORATION (JP) 2012-03-29 US disclosed
US-8088868-B2 oximation of cojugated homopolymers formed by addtion polymerization of conjugated diene monomer in the presence lanthanide copmpounds as polymerization catalysts; polymers used in the manufacture of tires having reduced hysteresis BRIDGESTONE CORPORATION (JP) 2012-01-03 US disclosed
US-20080146745-A1 POLYMERS FUNCTIONALIZED WITH PROTECTED OXIME COMPOUNDS BRIDGESTONE CORPORATION (JP) 2008-06-19 US disclosed