SCHEMBL211502

SCHEMBL211502

CCCCC=NOC(C)=O

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
TSHR P16473 1/20 0.36
CES2 O00748 1/20 0.35
FAAH O00519 4/20 0.34
SOAT1 P35610 2/20 0.34
F7 P08709 1/20 0.34
F3 P13726 1/20 0.34
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
KMT2A Q03164 1/20 0.34
ATM Q13315 1/20 0.33
MIF P14174 1/20 0.33
CNR1 P21554 1/20 0.32
CES1 P23141 1/20 0.32
PTGS2 P35354 1/20 0.32
KDM4E B2RXH2 2/20 0.32

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
SCHEMBL211501 1.00 ALDH1A1 (0.40) ALDH1A1TSHRCES2FAAHSOAT1
SCHEMBL212753 0.94 FAAH (0.41) ALDH1A1CES2FAAHSOAT1MEN1
SCHEMBL212752 0.94 FAAH (0.41) ALDH1A1CES2FAAHSOAT1MEN1
SCHEMBL215521 0.92 FAAH (0.44) CES2FAAHSOAT1MEN1TP53
SCHEMBL215177 0.92 FAAH (0.44) CES2FAAHSOAT1MEN1TP53
SCHEMBL215176 0.92 FAAH (0.44) CES2FAAHSOAT1MEN1TP53
SCHEMBL215520 0.92 FAAH (0.44) CES2FAAHSOAT1MEN1TP53
SCHEMBL2051976 0.89 ALDH1A1 (0.30) ALDH1A1
SCHEMBL2051006 0.89 ALDH1A1 (0.30) ALDH1A1
SCHEMBL2051975 0.89 ALDH1A1 (0.30) ALDH1A1

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 8 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
EP-2144894-B1 OXIME ESTER PHOTOINITIATORS BASF SE (DE) 2011-01-26 EP disclosed
US-20080146745-A1 POLYMERS FUNCTIONALIZED WITH PROTECTED OXIME COMPOUNDS BRIDGESTONE CORPORATION (JP) 2008-06-19 US disclosed