SCHEMBL2879088

SCHEMBL2879088

CC(=O)C(=Cc1ccc(O)c(O)c1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.57
EGFR P00533 5/20 0.54
KDM4E B2RXH2 6/20 0.52
ALDH1A1 P00352 5/20 0.52
IAPP P10997 2/20 0.51
PTGS1 P23219 1/20 0.51
ABL1 P00519 1/20 0.51
ABL2 P42684 1/20 0.51
JUN P05412 1/20 0.50
AKR1C3 P42330 1/20 0.49
TDP1 Q9NUW8 4/20 0.49
HSD17B10 Q99714 4/20 0.49
MEN1 O00255 3/20 0.49
HPGD P15428 3/20 0.49
KMT2A Q03164 3/20 0.49
GLA P06280 2/20 0.49
POLB P06746 2/20 0.49
GAA P10253 2/20 0.49
LMNA P02545 2/20 0.49
CYP3A4 P08684 2/20 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
SCHEMBL31452785 1.00 MAPT (0.57) MAPTEGFRKDM4EALDH1A1IAPP
SCHEMBL9315356 0.91 MAPT (0.67) MAPTEGFRKDM4EALDH1A1IAPP
SCHEMBL6380450 0.89 EGFR (0.61) MAPTEGFRKDM4EALDH1A1IAPP
SCHEMBL15082748 0.89 EGFR (0.61) MAPTEGFRKDM4EALDH1A1IAPP
SCHEMBL30161610 0.84 KDM4E (0.55) MAPTEGFRKDM4EALDH1A1IAPP
SCHEMBL31452778 0.84 MAPT (0.55) MAPTEGFRKDM4EALDH1A1IAPP
SCHEMBL2252350 0.82 MAPT (0.85) MAPTEGFRKDM4EALDH1A1PTGS1
SCHEMBL12394170 0.82 MAPT (0.85) MAPTEGFRKDM4EALDH1A1PTGS1
SCHEMBL5597360 0.82 MAPT (0.85) MAPTEGFRKDM4EALDH1A1PTGS1
SCHEMBL2535852 0.81 EGFR (0.57) MAPTEGFRKDM4EALDH1A1IAPP

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-2166871-A1 TASTE POTENTIATOR COMPOSITIONS IN ORAL DELIVERY SYSTEMS Cadbury Adams USA LLC (US) 2010-03-31 EP disclosed
WO-2008141333-A1 TASTE POTENTIATOR COMPOSITIONS IN ORAL DELIVERY SYSTEMS CADBURY ADAMS USA LLC (US) 2008-11-20 WO disclosed