SCHEMBL28028294

SCHEMBL28028294

CCCCCCCCCCCCCCCCCCOC(=O)/C=C\C(=O)OCC(O)CO

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.61
KDM4E B2RXH2 1/20 0.58
DUSP3 P51452 1/20 0.58
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
LMNA P02545 1/20 0.58
ATM Q13315 1/20 0.58
USP2 O75604 1/20 0.56
DGKA P23743 1/20 0.54
FAAH O00519 2/20 0.48
MAPT P10636 1/20 0.45
RAB9A P51151 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
APP P05067 3/20 0.44

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
SCHEMBL26111999 1.00 HCAR2 (0.61) HCAR2KDM4EDUSP3MEN1KMT2A
SCHEMBL28194144 0.88 KDM4E (0.60) HCAR2KDM4EDUSP3MEN1KMT2A
SCHEMBL11609880 0.88 TSHR (0.60) HCAR2KDM4EDUSP3MEN1KMT2A
Hexadecane SCHEMBL28028773 0.88 HCAR2 (0.61) HCAR2KDM4EDUSP3MEN1KMT2A
Glycerin SCHEMBL6111618 0.85 ATM (0.74) HCAR2KDM4EDUSP3MEN1KMT2A
Glycerin SCHEMBL6111614 0.85 ATM (0.74) HCAR2KDM4EDUSP3MEN1KMT2A
SCHEMBL31439416 0.83 DGKA (0.68) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL20719742 0.83 DGKA (0.68) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL21772714 0.83 DGKA (0.68) KDM4EDUSP3MEN1KMT2ALMNA
SCHEMBL1427818 0.83 DGKA (0.68) KDM4EDUSP3MEN1KMT2ALMNA

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-104888669-A Color hydrogel and preparation method thereof SUZHOU INST NANO TECH & NANO B 2015-09-09 CN disclosed