SCHEMBL6200317

SCHEMBL6200317

CCCCC(O)CCCC(O)CCCC(c1nnn[nH]1)c1nnn[nH]1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.35
FFAR1 O14842 1/20 0.35
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
GPR84 Q9NQS5 5/20 0.33
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
KDM4E B2RXH2 1/20 0.31
NFKB1 P19838 1/20 0.31

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
SCHEMBL16799873 0.82 MAPT (0.37) FFAR4FFAR1GPR84LMNA
SCHEMBL6200312 0.77
SCHEMBL4941600 0.75 GPR84 (0.34) FFAR1GPR84LMNAKDM4E
SCHEMBL5705327 0.75 MAPT (0.42) FFAR4FFAR1GPR84ALDH1A1
SCHEMBL5705372 0.75 MAPT (0.42) FFAR4FFAR1GPR84ALDH1A1
SCHEMBL19003499 0.74 DNM1 (0.30)
SCHEMBL6216857 0.72
SCHEMBL6242225 0.71
SCHEMBL5027006 0.71 FFAR4 (0.50) FFAR4FFAR1GPR84ALDH1A1NFKB1
Hydrochloric Acid SCHEMBL8089311 0.70 SLC2A1 (0.32)

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
EP-1597223-A2 HYDROXYL COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES Esperion Therapeutics Inc. (US) 2005-11-23 EP disclosed
WO-2004067489-A2 HYDROXYL COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES ESPERION THERAPEUTICS, INC. (US) 2004-08-12 WO disclosed