SCHEMBL14218294

SCHEMBL14218294

C/C=C(\C=C/CC)/C=C/C(=O)OCC1CO1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 3/20 0.42
ALDH1A1 P00352 1/20 0.41
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
HCAR2 Q8TDS4 1/20 0.32
ATM Q13315 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
SCHEMBL3090220 0.88 MGLL (0.48) MGLLALDH1A1TP53CYP3A4
SCHEMBL3090223 0.88 MGLL (0.48) MGLLALDH1A1TP53CYP3A4
SCHEMBL624267 0.80 MGLL (0.55) MGLLALDH1A1TP53CYP3A4
SCHEMBL268635 0.80 MGLL (0.55) MGLLALDH1A1TP53CYP3A4
SCHEMBL268634 0.80 MGLL (0.55) MGLLALDH1A1TP53CYP3A4
SCHEMBL1286819 0.79 HCAR2 (0.52) MGLLALDH1A1TP53CYP3A4HCAR2
SCHEMBL8054471 0.79 HCAR2 (0.52) MGLLALDH1A1TP53CYP3A4HCAR2
SCHEMBL1286817 0.79 HCAR2 (0.52) MGLLALDH1A1TP53CYP3A4HCAR2
SCHEMBL157947 0.77 MGLL (0.50) MGLLALDH1A1TP53CYP3A4
SCHEMBL29384631 0.77 MGLL (0.50) MGLLALDH1A1TP53CYP3A4

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
EP-1923418-A1 STAR POLYMER AND PROCESS FOR PRODUCTION THEREOF NIPPON SODA CO., LTD. (JP) 2008-05-21 EP disclosed