SCHEMBL10885266

SCHEMBL10885266

CCCCCc1[nH]c(=O)[nH]c1CO

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 14/20 0.44
TYMP P19971 4/20 0.44
KCNH2 Q12809 1/20 0.37
HCAR2 Q8TDS4 1/20 0.36

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
SCHEMBL10964068 0.80 GPR84 (0.44) GPR84TYMPHCAR2
SCHEMBL10885262 0.73 GPR84 (0.42) GPR84TYMPHCAR2
SCHEMBL30968704 0.72 TYMP (0.51) GPR84TYMPHCAR2
SCHEMBL14524977 0.71 TYMP (0.48) GPR84TYMPHCAR2
SCHEMBL10197626 0.65 GPR84 (0.38) GPR84TYMP
SCHEMBL22579524 0.65 KDM4E (0.33) GPR84TYMP
SCHEMBL25344146 0.64 TYMP (0.46) TYMP
Tetrabuthylammonium SCHEMBL1284221 0.63 SLC22A1 (0.60) GPR84TYMP
SCHEMBL891089 0.63 TYMP (0.46) GPR84TYMP
Palmitic Acid SCHEMBL31098101 0.61 GPR84 (0.71) GPR84

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-0065165-B1 5-OXYMETHYL-4-ACYL-1,3-DIHYDRO-2H-IMIDAZOL-2-ONES MERRELL DOW PHARMACEUTICALS INC. (US) 1986-06-18 EP disclosed
EP-0065165-A1 5-Oxymethyl-4-acyl-1,3-dihydro-2H-imidazol-2-ones MERRELL DOW PHARMACEUTICALS INC. (US) 1982-11-24 EP disclosed