SCHEMBL3962791

SCHEMBL3962791

CCCCCC(CCCCC(=O)O)N1C(=O)C=CC1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.51
FFAR1 O14842 2/20 0.51
AKR1B1 P15121 1/20 0.50
GPR84 Q9NQS5 7/20 0.48
PPARG P37231 7/20 0.48
PPARD Q03181 7/20 0.48
PPARA Q07869 7/20 0.48
HDAC11 Q96DB2 5/20 0.48
TSHR P16473 4/20 0.48
PTPN1 P18031 3/20 0.48
ALDH1A1 P00352 2/20 0.48
TLR2 O60603 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
FABP4 P15090 2/20 0.48
SLC22A6 Q4U2R8 1/20 0.48
SLC22A8 Q8TCC7 1/20 0.48
MEN1 O00255 1/20 0.48
ESR1 P03372 1/20 0.48
ALOX15 P16050 1/20 0.48
PDE4A P27815 1/20 0.48

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
SCHEMBL7053269 0.97 FFAR4 (0.47) FFAR4FFAR1AKR1B1GPR84PPARG
SCHEMBL28406949 0.88 PTGS1 (0.50) FFAR4FFAR1GPR84PPARGPPARD
SCHEMBL23386918 0.87 MGLL (0.48) GPR84ALDH1A1MEN1KMT2APTGS1
SCHEMBL23325771 0.85 MGLL (0.52) FFAR1GPR84ALDH1A1MEN1KMT2A
SCHEMBL25062132 0.85 MGLL (0.52) FFAR1GPR84ALDH1A1MEN1KMT2A
SCHEMBL21152746 0.85 MGLL (0.52) FFAR1GPR84ALDH1A1MEN1KMT2A
SCHEMBL23900873 0.85 MGLL (0.52) FFAR1GPR84ALDH1A1MEN1KMT2A
SCHEMBL24153641 0.81 MGLL (0.45) TSHRALDH1A1PTGS1PTGS2
SCHEMBL29028229 0.81 GPR84 (0.40) GPR84PTGS1PTGS2
SCHEMBL22972984 0.80 MGLL (0.46) ALDH1A1MEN1KMT2APTGS1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7538092-B2 Pharmaceutically active oligosaccharide conjugates FRESENIUS KABI DEUTSCHLAND GMBH (DE) 2009-05-26 US claimed
US-20060100163-A1 Pharmaceutically active oligosaccharide conjugates FRESENIUS KABI DEUTSCHLAND GMBH (DE) 2006-05-11 US claimed