SCHEMBL630617

SCHEMBL630617

O=C(O)CC[C@H](O)CCCCO

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.53
FFAR1 O14842 2/20 0.53
PTPN1 P18031 1/20 0.53
GPR84 Q9NQS5 6/20 0.52
CAMK2A Q9UQM7 1/20 0.50
TET2 Q6N021 3/20 0.44
KDM4A O75164 2/20 0.44
KDM4C Q9H3R0 2/20 0.44
KDM2A Q9Y2K7 2/20 0.44
TET3 O43151 1/20 0.44
CYP1A2 P05177 1/20 0.43
FAAH O00519 1/20 0.40

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
SCHEMBL446026 1.00 FFAR4 (0.53) FFAR4FFAR1PTPN1GPR84CAMK2A
SCHEMBL15541850 0.98 FFAR4 (0.57) FFAR4FFAR1PTPN1GPR84CAMK2A
SCHEMBL3337297 0.93 PTPN1 (0.55) FFAR4FFAR1PTPN1GPR84CAMK2A
SCHEMBL31512908 0.89 FFAR4 (0.57) FFAR4FFAR1PTPN1GPR84CAMK2A
SCHEMBL18955820 0.89 FFAR1 (0.70) FFAR4FFAR1PTPN1GPR84CAMK2A
SCHEMBL6838371 0.89 FFAR1 (0.70) FFAR4FFAR1PTPN1GPR84CAMK2A
SCHEMBL30497569 0.89 FFAR1 (0.70) FFAR4FFAR1PTPN1GPR84CAMK2A
SCHEMBL19351243 0.89 FFAR1 (0.70) FFAR4FFAR1PTPN1GPR84CAMK2A
SCHEMBL29123834 0.89 FFAR1 (0.70) FFAR4FFAR1PTPN1GPR84CAMK2A
SCHEMBL30497568 0.89 FFAR1 (0.70) FFAR4FFAR1PTPN1GPR84CAMK2A

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-2419519-A1 PROCESS FOR THE PREPARATION OF (3R)-HYDR0XYBUTYL (3R) -HYDROXYBUTYRATE BY ENZYMATIC ENANTIOSELECTIVE REDUCTION EMPLOYING LACTOBACILLUS BREVIS ALCOHOL DEHYDROGENASE Isis Innovation Limited (GB) 2012-02-22 EP disclosed