SCHEMBL3285285

SCHEMBL3285285

CCCCCCCCC(CC(=O)O)OC(CCCCCCCC)CC(=O)O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.60
MAPK1 P28482 4/20 0.49
MAPT P10636 4/20 0.49
GMNN O75496 3/20 0.49
LMNA P02545 3/20 0.49
NPSR1 Q6W5P4 3/20 0.49
CYP1A2 P05177 3/20 0.49
MEN1 O00255 2/20 0.49
HSP90AA1 P07900 2/20 0.49
BLM P54132 2/20 0.49
KMT2A Q03164 2/20 0.49
NR1H4 Q96RI1 2/20 0.49
TP53 P04637 1/20 0.49
CYP2C9 P11712 1/20 0.49
TSHR P16473 1/20 0.49
HIF1A Q16665 1/20 0.49
FFAR1 O14842 2/20 0.48
FFAR4 Q5NUL3 1/20 0.48
GLA P06280 1/20 0.47
PMP22 Q01453 1/20 0.47

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
SCHEMBL3280835 1.00 GPR84 (0.60) GPR84MAPK1MAPTGMNNLMNA
SCHEMBL9423042 0.92 GPR84 (0.48) GPR84MAPK1MAPTGMNNLMNA
SCHEMBL28590845 0.86 GPR84 (0.58) GPR84MAPK1MAPTGMNNLMNA
SCHEMBL20472006 0.86 GPR84 (0.58) GPR84MAPK1MAPTGMNNLMNA
SCHEMBL20471823 0.86 GPR84 (0.58) GPR84MAPK1MAPTGMNNLMNA
SCHEMBL23723113 0.86 GPR84 (0.58) GPR84MAPK1MAPTGMNNLMNA
SCHEMBL12371513 0.86 GPR84 (0.58) GPR84MAPK1MAPTGMNNLMNA
SCHEMBL9335548 0.85 GPR84 (0.56) GPR84MAPK1MAPTGMNNLMNA
SCHEMBL9019462 0.85 GPR84 (0.56) GPR84MAPK1MAPTGMNNLMNA
SCHEMBL28183600 0.84 GPR84 (0.55) GPR84MAPK1MAPTGMNNLMNA

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
US-7704939-B2 Surfactant SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2010-04-27 US disclosed
US-20070167343-A1 neutralized salt including alkylbenzenesulphonates (toluenesulfonic acid guanidine salt, toluenesulfonic acid DBU salt, toluenesulfonic acid DBN salt) for cleaning electonics SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2007-07-19 US disclosed