SCHEMBL28307359

SCHEMBL28307359

CCOC(=O)C(N)(CC)CCC(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.42
HPGD P15428 1/20 0.42
MMP8 P22894 1/20 0.40
CYP4F2 P78329 2/20 0.39
CYP4A11 Q02928 2/20 0.39
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
ALDH1A1 P00352 4/20 0.35
THRB P10828 2/20 0.35
CYP1A2 P05177 1/20 0.35
PKM P14618 2/20 0.35
POLB P06746 1/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ATM Q13315 2/20 0.32
MAPT P10636 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL28308258 0.81 MMP8 (0.50) HTTHPGDMMP8CYP4F2CYP4A11
SCHEMBL3176588 0.80 ALOX15 (0.46) HTTHPGDMMP8CYP4F2CYP4A11
SCHEMBL28308283 0.80 MMP8 (0.45) HTTHPGDMMP8CYP4F2CYP4A11
SCHEMBL28308253 0.79 HTT (0.42) HTTHPGDMMP8CYP4F2CYP4A11
Hydrochloric Acid SCHEMBL14152453 0.78 ALOX15 (0.44) HTTHPGDMMP8CYP4F2CYP4A11
SCHEMBL28077465 0.78 MEN1 (0.46) HTTHPGDMMP8CYP4F2CYP4A11
SCHEMBL485688 0.78 CYP4F2 (0.44) HTTCYP4F2CYP4A11MEN1KMT2A
SCHEMBL11143931 0.77 MEN1 (0.59) HTTHPGDMEN1KMT2AALDH1A1
SCHEMBL234357 0.77 MEN1 (0.53) HTTHPGDMMP8CYP4F2CYP4A11
SCHEMBL23907058 0.76 MMP8 (0.45) HTTHPGDMMP8CYP4F2CYP4A11

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-109890852-A Catalyst components for the polymerization of olefins 巴塞尔聚烯烃意大利有限公司 2019-06-14 CN disclosed