SCHEMBL28512089

SCHEMBL28512089

CCCCCC(C#N)(CC(=O)OCC)C(=O)OCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPT P10636 1/20 0.43
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 2/20 0.38
TSHR P16473 2/20 0.38
CYP4F2 P78329 2/20 0.37
CYP4A11 Q02928 2/20 0.37
THRB P10828 1/20 0.37
PKM P14618 1/20 0.37
HTT P42858 1/20 0.36
GAA P10253 2/20 0.33
MGAM O43451 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
NAAA Q02083 1/20 0.32
DGKA P23743 1/20 0.32
CYP1A2 P05177 1/20 0.32
TRPA1 O75762 1/20 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
SCHEMBL14016347 0.85 MEN1 (0.46) MEN1KMT2AALDH1A1TSHRCYP4F2
SCHEMBL7709450 0.84 MEN1 (0.49) MEN1KMT2AMAPTATML3MBTL1
SCHEMBL29000578 0.82 PAM (0.44) MEN1KMT2AMAPTATML3MBTL1
SCHEMBL15451360 0.82 MEN1 (0.43) MEN1KMT2AALDH1A1TSHRCYP4F2
SCHEMBL28464690 0.81 MEN1 (0.41) MEN1KMT2AALDH1A1TSHRCYP4F2
SCHEMBL8508970 0.80 MEN1 (0.40) MEN1KMT2AMAPTATML3MBTL1
SCHEMBL4383809 0.79 MEN1 (0.34) MEN1KMT2AMAPTATML3MBTL1
SCHEMBL2638021 0.77 MMP8 (0.43) MEN1KMT2AALDH1A1TSHRGAA
SCHEMBL15437899 0.77 MEN1 (0.39) MEN1KMT2AMAPTALDH1A1TSHR
SCHEMBL7722774 0.77 MEN1 (0.52) MEN1KMT2AMAPTATML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116023553-A Catalyst for olefin polymerization reaction, catalyst system and application 中国石油化工股份有限公司 2023-04-28 CN disclosed
CN-109111535-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-03-16 CN disclosed
CN-107344979-B Catalyst component for olefin polymerization, catalyst system and application thereof 中国石油化工股份有限公司 2021-03-16 CN disclosed
CN-109111538-B Catalyst component for olefin polymerization and catalyst thereof 中国石油化工股份有限公司 2021-02-05 CN disclosed