SCHEMBL28033833

SCHEMBL28033833

CCCCOC(=O)/C=C(/CCCC)C(=O)OCC

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.52
TSHR P16473 3/20 0.49
HPGD P15428 1/20 0.49
HCAR2 Q8TDS4 3/20 0.46
NPSR1 Q6W5P4 2/20 0.46
ALDH1A1 P00352 2/20 0.41
FAAH O00519 2/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
DNM1 Q05193 1/20 0.36
APP P05067 1/20 0.35
NAAA Q02083 1/20 0.34
DGKA P23743 1/20 0.34
GLO1 Q04760 1/20 0.34

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
SCHEMBL3604815 0.93 ATM (0.55) ATMTSHRHPGDHCAR2NPSR1
SCHEMBL3296923 0.93 ATM (0.55) ATMTSHRHPGDHCAR2NPSR1
SCHEMBL1244643 0.93 ATM (0.55) ATMTSHRHPGDHCAR2NPSR1
SCHEMBL8846378 0.93 ATM (0.55) ATMTSHRHPGDHCAR2NPSR1
SCHEMBL1244640 0.93 ATM (0.55) ATMTSHRHPGDHCAR2NPSR1
SCHEMBL27365356 0.92 ATM (0.53) ATMTSHRHPGDHCAR2NPSR1
SCHEMBL7772618 0.91 NPSR1 (0.55) ATMTSHRHPGDHCAR2NPSR1
SCHEMBL1244622 0.91 NPSR1 (0.55) ATMTSHRHPGDHCAR2NPSR1
SCHEMBL1244624 0.91 NPSR1 (0.55) ATMTSHRHPGDHCAR2NPSR1
SCHEMBL28167344 0.87 HCAR2 (0.51) ATMTSHRHPGDHCAR2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105085730-A Catalyst component for olefin polymerization, preparation method and catalyst thereof CHINA PETROLEUM & CHEMICAL 2015-11-25 CN disclosed
CN-105085748-A Catalyst component for propylene polymerization, and catalyst thereof CHINA PETROLEUM & CHEMICAL 2015-11-25 CN disclosed
CN-105085728-A Method for preparing catalyst component for olefin polymerization, and catalyst for olefin polymerization CHINA PETROLEUM & CHEMICAL 2015-11-25 CN disclosed