SCHEMBL10148382

SCHEMBL10148382

CCCCCCC(C(=O)O)C(N)CC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.52
FFAR1 O14842 1/20 0.52
GRIK1 P39086 2/20 0.51
GRIK2 Q13002 2/20 0.51
MAPT P10636 2/20 0.50
LCK P06239 1/20 0.50
PPARD Q03181 1/20 0.50
ZDHHC20 Q5W0Z9 1/20 0.50
ZDHHC2 Q9UIJ5 1/20 0.50
SLC1A2 P43004 1/20 0.49
SLC1A1 P43005 1/20 0.49
ACE2 Q9BYF1 1/20 0.47
CYP2D6 P10635 2/20 0.44
SPHK1 Q9NYA1 1/20 0.44
GMNN O75496 1/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
THPO P40225 1/20 0.44
MTOR P42345 1/20 0.44
BLM P54132 1/20 0.44

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
SCHEMBL16903919 0.98 GRIK1 (0.50) GPR84FFAR1GRIK1GRIK2MAPT
SCHEMBL265336 0.88 GRIK1 (0.52) GPR84FFAR1GRIK1GRIK2MAPT
SCHEMBL6899601 0.85 CA1 (0.47) GPR84FFAR1GRIK1GRIK2MAPT
SCHEMBL6896361 0.85 CA1 (0.47) GPR84FFAR1GRIK1GRIK2MAPT
SCHEMBL14369537 0.85 CA1 (0.47) GPR84FFAR1GRIK1GRIK2MAPT
SCHEMBL12438372 0.85 GPR84 (0.52) GPR84FFAR1GRIK1GRIK2MAPT
Oleic Acid SCHEMBL28995249 0.84 PPARG (0.62) FFAR1MAPTPPARDGMNNLMNA
SCHEMBL136413 0.84 CHRM1 (0.46) GRIK1GRIK2SLC1A2SLC1A1
SCHEMBL337767 0.83 GPR84 (0.64) GPR84FFAR1GRIK1GRIK2MAPT
SCHEMBL5547897 0.83 GPR84 (0.64) GPR84FFAR1GRIK1GRIK2MAPT

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-2027107-B1 2, 4 -DIAMINO PYRIMIDINES AS CELL CYCLE KINASE INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2012-02-15 EP disclosed