SCHEMBL10799286

SCHEMBL10799286

CCCc1c(O)[c]ccc1OCc1ccc(CCC#N)cc1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.34
CYSLTR1 Q9Y271 2/20 0.34
CYSLTR2 Q9NS75 1/20 0.34
CTSD P07339 4/20 0.33
FFAR1 O14842 2/20 0.33
FFAR4 Q5NUL3 2/20 0.33
GRM2 Q14416 1/20 0.32
BCHE P06276 1/20 0.31
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 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
SCHEMBL10799752 0.93 CYSLTR1 (0.33) GPR84CYSLTR1CYSLTR2CTSDFFAR1
SCHEMBL10804059 0.85 CYSLTR1 (0.34) GPR84CYSLTR1CYSLTR2CTSDFFAR1
SCHEMBL10799322 0.84 MEN1 (0.36) GPR84CYSLTR1CYSLTR2CTSDFFAR1
SCHEMBL10798392 0.83 CYSLTR1 (0.33) GPR84CYSLTR1CYSLTR2CTSDFFAR1
SCHEMBL10975508 0.81 ESR1 (0.35) GPR84CYSLTR1CYSLTR2CTSDGRM2
SCHEMBL10799377 0.75 CYSLTR1 (0.39) GPR84CYSLTR1CYSLTR2CTSDGRM2
SCHEMBL10798437 0.74 CYSLTR1 (0.38) GPR84CYSLTR1CYSLTR2CTSDGRM2
SCHEMBL10798690 0.73 CYSLTR1 (0.39) GPR84CYSLTR1CYSLTR2CTSDGRM2
SCHEMBL10798791 0.72 CYSLTR1 (0.36) GPR84CYSLTR1CYSLTR2CTSDGRM2
SCHEMBL10773760 0.71 HMGCR (0.41)

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-0132124-B1 NOVEL PHARMACEUTICAL COMPOUNDS AND THEIR PREPARATION Lilly Industries Limited (GB) 1987-09-23 EP disclosed
EP-0132124-A1 Novel pharmaceutical compounds and their preparation Lilly Industries Limited (GB) 1985-01-23 EP disclosed