SCHEMBL28025322

SCHEMBL28025322

CCCCOCCOC(CCCC(=O)OCC)(OCCOCCCC)C(=O)OCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
DGKA P23743 1/20 0.40
CYP1A2 P05177 1/20 0.40
MAPT P10636 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ATM Q13315 1/20 0.35
DNM1 Q05193 1/20 0.35
PAM P19021 2/20 0.34
NR1I2 O75469 1/20 0.34
PGR P06401 1/20 0.34
ADORA3 P0DMS8 1/20 0.34
PTGS2 P35354 1/20 0.34
PDE4D Q08499 1/20 0.34
TSHR P16473 3/20 0.33
CYP3A4 P08684 2/20 0.33
GAA P10253 1/20 0.33
EPHX2 P34913 1/20 0.33

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
SCHEMBL15251952 0.89 CYP4F2 (0.41) CYP4F2CYP4A11MAPTL3MBTL1MEN1
SCHEMBL17908715 0.81 DGKA (0.53) DGKACYP1A2MAPTMEN1KMT2A
SCHEMBL17909089 0.81 DGKA (0.53) DGKACYP1A2MAPTMEN1KMT2A
SCHEMBL17909038 0.81 DGKA (0.53) DGKACYP1A2MAPTMEN1KMT2A
SCHEMBL15478668 0.79 DGKA (0.55) DGKACYP1A2MAPTATMDNM1
SCHEMBL2849672 0.78 DGKA (0.66) CYP4F2CYP4A11DGKACYP1A2MAPT
SCHEMBL15478676 0.78 DGKA (0.59) DGKACYP1A2MAPTATMDNM1
SCHEMBL17909594 0.76 DGKA (0.57) DGKACYP1A2MAPTMEN1KMT2A
SCHEMBL17909349 0.76 DGKA (0.57) DGKACYP1A2MAPTMEN1KMT2A
SCHEMBL17909586 0.76 DGKA (0.57) DGKACYP1A2MAPTMEN1KMT2A

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-104817739-A Low-hardness NBR (nitrile-butadiene rubber) sealing element material for automobile transmission converters and preparation method thereof NANJING JINSANLI RUBBER & PLASTIC CO LTD 2015-08-05 CN disclosed