SCHEMBL7438181

SCHEMBL7438181

CCCCC(O)C1(C(=O)O)CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.37
MAPK1 P28482 1/20 0.37
GPR84 Q9NQS5 7/20 0.36
FFAR1 O14842 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ACHE P22303 1/20 0.34
BACE1 P56817 1/20 0.34
CTSL P07711 1/20 0.34
CTSB P07858 1/20 0.34
CTSK P43235 1/20 0.34
CYP2C19 P33261 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33

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
SCHEMBL13875771 1.00 CA2 (0.37) CA2MAPK1GPR84FFAR1MEN1
SCHEMBL11387148 0.89 CHRM1 (0.35) GPR84FFAR1MEN1KMT2ACYP2C19
SCHEMBL3294375 0.84 GPR84 (0.50) GPR84FFAR1FFAR4
SCHEMBL17099453 0.84 GPR84 (0.50) GPR84FFAR1FFAR4
SCHEMBL21085055 0.83 CA2 (0.35) CA2MAPK1GPR84FFAR1MEN1
SCHEMBL17507162 0.81 CYP2C19 (0.38) MEN1KMT2ACYP2C19
SCHEMBL14576719 0.81 CA2 (0.36) CA2MAPK1GPR84FFAR1MEN1
SCHEMBL14037320 0.79 CYP2C19 (0.34) MEN1KMT2ACYP2C19
SCHEMBL17818503 0.78 GPR84 (0.41) GPR84FFAR1KMT2AFFAR4
SCHEMBL1469950 0.77 CHRM1 (0.38) MEN1KMT2ACTSLCTSBCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1399634-A Hydroxyalkanoyl aminolactams and related structure as inhibitors of A beta protein production BRISTOL MYERS SQUIBB PHARMA IN (US) 2003-02-26 CN claimed
CN-1399634-A Hydroxyalkanoyl aminolactams and related structure as inhibitors of A beta protein production BRISTOL MYERS SQUIBB PHARMA IN (US) 2003-02-26 CN disclosed
EP-1212306-A2 HYDROXYALKANOYLAMINOLACTAMS AND RELATED STRUCTURES AS INHIBITORS OF ABETA PROTEIN PRODUCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2002-06-12 EP disclosed
WO-2001019797-A2 HYDROXYALKANOYL AMINOLACTAMS AND RELATED STRUCTURES AS INHIBITORS OF Aβ PROTEIN PRODUCTION DU PONT PHARMACEUTICALS COMPANY (US) 2001-03-22 WO disclosed