SCHEMBL28804166

SCHEMBL28804166

C=CCOCOC(=O)C(CCCC)(CCCCCC)CCCCCCCC

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.46
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ZDHHC20 Q5W0Z9 1/20 0.35
ZDHHC2 Q9UIJ5 1/20 0.35
HPGD P15428 1/20 0.33
FAAH O00519 1/20 0.33
CES2 O00748 1/20 0.33
PAM P19021 2/20 0.32
PLA2G2C Q5R387 1/20 0.32
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
TRPV1 Q8NER1 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
SCHEMBL28804268 0.90 TSHR (0.41) TSHRCYP4F2CYP4A11HPGD
SCHEMBL28804206 0.87 TSHR (0.36) TSHRCYP4F2CYP4A11
SCHEMBL8763640 0.80 TSHR (0.54) TSHRCYP4F2CYP4A11MEN1MAPT
SCHEMBL28462437 0.76 CYP4F2 (0.59) CYP4F2CYP4A11MEN1MAPTKMT2A
SCHEMBL11482882 0.75 THRB (0.35) TSHRCYP4F2CYP4A11MEN1KMT2A
SCHEMBL28490929 0.74 NAAA (0.47) TSHRCYP4F2CYP4A11MEN1MAPT
SCHEMBL28774030 0.74 NAAA (0.47) TSHRCYP4F2CYP4A11MEN1MAPT
SCHEMBL9771304 0.74 NAAA (0.47) TSHRCYP4F2CYP4A11MEN1MAPT
SCHEMBL9136869 0.74 NAAA (0.47) TSHRCYP4F2CYP4A11MEN1MAPT
SCHEMBL29128128 0.74 NAAA (0.47) TSHRCYP4F2CYP4A11MEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108349919-B Polyfunctional epoxy compound and curable composition containing the same 日产化学工业株式会社 2022-06-03 CN disclosed