SCHEMBL1802161

SCHEMBL1802161

C=C(CC(C)N1CC1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TET2 Q6N021 4/20 0.43
TET3 O43151 1/20 0.43
TET1 Q8NFU7 1/20 0.43
GRIK1 P39086 1/20 0.42
GRIK2 Q13002 1/20 0.42
GRM1 Q13255 1/20 0.42
GRM2 Q14416 1/20 0.42
RAD52 P43351 1/20 0.40
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 2/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
REN P00797 1/20 0.31
ACE P12821 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
SCHEMBL20610094 0.92 ALDH1A1 (0.43) TET2TET3TET1GRIK1GRIK2
SCHEMBL20610048 0.87 ALDH1A1 (0.41) TET2TET3TET1GRIK1GRIK2
SCHEMBL5498249 0.80 KDM4E (0.35) TET2TET3TET1GRIK1GRIK2
SCHEMBL1174393 0.78
SCHEMBL4181286 0.78 KDM4E (0.54) RAD52KDM4EALDH1A1POLBMAPT
SCHEMBL20407367 0.73
SCHEMBL21715 0.72
SCHEMBL20610093 0.72 TET2 (0.41) TET2TET3TET1GRIK1GRIK2
SCHEMBL3128590 0.71 KDM4E (0.49) RAD52KDM4EALDH1A1POLBMAPT
SCHEMBL36381 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7951429-B2 High energy curable coatings comprising thermoplastic polymers THE SHERWIN-WILLIAMS COMPANY (US) 2011-05-31 US disclosed
US-20090214877-A1 HIGH ENERGY CURABLE COATINGS COMPRISING THERMOPLASTIC POLYMERS THE SHERWIN-WILLIAMS COMPANY (US) 2009-08-27 US disclosed