SCHEMBL8780386

SCHEMBL8780386

CCCCCc1ccccc1-c1ccccc1CCC(=O)O

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 10/20 0.58
CYSLTR1 Q9Y271 10/20 0.58
PTGER1 P34995 1/20 0.54
PTGER4 P35408 1/20 0.54
PTGER3 P43115 1/20 0.54
PTGER2 P43116 1/20 0.54
PPARA Q07869 2/20 0.51
BID P55957 3/20 0.49
MCL1 Q07820 3/20 0.49
BCL2L1 Q07817 2/20 0.49
BAK1 Q16611 2/20 0.49
KAT8 Q9H7Z6 2/20 0.49
PPARG P37231 1/20 0.49
EP300 Q09472 1/20 0.49
KAT2A Q92830 1/20 0.49
KAT2B Q92831 1/20 0.49
KAT5 Q92993 1/20 0.49
SAE1 Q9UBE0 1/20 0.49

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
SCHEMBL9484842 0.98 CYSLTR2 (0.60) CYSLTR2CYSLTR1PTGER1PTGER4PTGER3
SCHEMBL10435206 0.90 CYSLTR2 (0.64) CYSLTR2CYSLTR1PPARABIDMCL1
SCHEMBL18920823 0.86 CYSLTR2 (0.55) CYSLTR2CYSLTR1PTGER1PTGER4PTGER3
SCHEMBL71453 0.86 PTGER4 (0.68) PTGER1PTGER4PTGER3PTGER2
SCHEMBL9484846 0.84 PTGER1 (0.62) CYSLTR2CYSLTR1PTGER1PTGER4PTGER3
SCHEMBL1024526 0.84 LIPG (0.59) CYSLTR2CYSLTR1PPARABIDMCL1
SCHEMBL25170031 0.83 CYSLTR2 (0.68) CYSLTR2CYSLTR1PPARAPPARG
SCHEMBL27262058 0.83 CYSLTR2 (0.68) CYSLTR2CYSLTR1PPARAPPARG
Bicarbonate SCHEMBL1838326 0.82 PPARA (0.53) CYSLTR2CYSLTR1PPARABIDMCL1
SCHEMBL4826250 0.82 PTPN11 (0.55) CYSLTR2CYSLTR1PPARABIDMCL1

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-0788511-A1 CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-08-13 EP disclosed