SCHEMBL8812932

SCHEMBL8812932

C=CCCCC=CCOC(=O)C=CC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 8/20 0.44
MAPT P10636 5/20 0.41
CACNA1B Q00975 1/20 0.41
APBA1 Q02410 1/20 0.41
ALDH1A1 P00352 1/20 0.37
ABCC4 O15439 1/20 0.36
CYP3A4 P08684 2/20 0.36
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36
RECQL P46063 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
APP P05067 1/20 0.35
CYP2C9 P11712 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
SCHEMBL8812925 1.00 HCAR2 (0.44) HCAR2MAPTCACNA1BAPBA1ALDH1A1
SCHEMBL4651809 0.93 MAPT (0.46) HCAR2MAPTCACNA1BAPBA1ALDH1A1
SCHEMBL4651813 0.93 MAPT (0.46) HCAR2MAPTCACNA1BAPBA1ALDH1A1
SCHEMBL4651805 0.93 MAPT (0.46) HCAR2MAPTCACNA1BAPBA1ALDH1A1
SCHEMBL4653141 0.93 MAPT (0.46) HCAR2MAPTCACNA1BAPBA1ALDH1A1
SCHEMBL4653142 0.93 MAPT (0.46) HCAR2MAPTCACNA1BAPBA1ALDH1A1
Maleic Acid SCHEMBL7773450 0.92 HCAR2 (0.50) HCAR2MAPTCACNA1BAPBA1ALDH1A1
SCHEMBL7776939 0.85 MAPT (0.44) HCAR2MAPTCACNA1BAPBA1ALDH1A1
SCHEMBL7776938 0.85 MAPT (0.44) HCAR2MAPTCACNA1BAPBA1ALDH1A1
SCHEMBL7776943 0.85 MAPT (0.44) HCAR2MAPTCACNA1BAPBA1ALDH1A1

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
WO-1997002326-A1 REACTIVE DILUENTS BP CHEMICALS LIMITED (GB) 1997-01-23 WO disclosed