SCHEMBL28680871

SCHEMBL28680871

CCCCCCCCCCOCCCNCC(O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.47
MEN1 O00255 1/20 0.47
THRB P10828 1/20 0.47
KMT2A Q03164 1/20 0.47
MAPT P10636 1/20 0.47
USP2 O75604 1/20 0.46
EPHX2 P34913 3/20 0.41
SPHK1 Q9NYA1 1/20 0.41
ANPEP P15144 1/20 0.41
ERAP2 Q6P179 1/20 0.41
CES2 O00748 2/20 0.41
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LPAR5 Q9H1C0 1/20 0.39
PLA2G2C Q5R387 1/20 0.38
TSHR P16473 2/20 0.38
CES1 P23141 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL10731391 0.93 HTT (0.47) HTTMEN1THRBKMT2AMAPT
SCHEMBL10575770 0.93 HTT (0.47) HTTMEN1THRBKMT2AMAPT
SCHEMBL117025 0.84 TSHR (0.55) ANPEPERAP2ALDH1A1TSHR
SCHEMBL3974540 0.84 TSHR (0.55) ANPEPERAP2ALDH1A1TSHR
SCHEMBL76228 0.84 TSHR (0.55) ANPEPERAP2ALDH1A1TSHR
SCHEMBL10980335 0.84 TSHR (0.55) ANPEPERAP2ALDH1A1TSHR
SCHEMBL8073304 0.84 TSHR (0.55) ANPEPERAP2ALDH1A1TSHR
SCHEMBL1685867 0.84 TSHR (0.55) ANPEPERAP2ALDH1A1TSHR
SCHEMBL10530124 0.84 TSHR (0.55) ANPEPERAP2ALDH1A1TSHR
SCHEMBL6727152 0.84 TSHR (0.55) ANPEPERAP2ALDH1A1TSHR

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
CN-113912755-B Catalyst composition for olefin polymerization and application thereof 张一锴 2023-06-02 CN disclosed
CN-113912755-A Catalyst composition for olefin polymerization and application thereof 张一锴 2022-01-11 CN disclosed