SCHEMBL15744225

SCHEMBL15744225

C[C@H](C(=O)ON)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.48
PTGS2 P35354 2/20 0.47
PTGS1 P23219 2/20 0.47
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
PKM P14618 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ALOX5 P09917 1/20 0.44
FAAH O00519 1/20 0.42
LMNA P02545 2/20 0.42
ADRA2A P08913 1/20 0.42
ADRA2C P18825 1/20 0.42
HIF1A Q16665 1/20 0.42
KDM4E B2RXH2 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL8029603 1.00 KMT2A (0.48) KMT2APTGS2PTGS1CYP1A2CYP2D6
SCHEMBL6661724 1.00 KMT2A (0.48) KMT2APTGS2PTGS1CYP1A2CYP2D6
SCHEMBL5692490 0.83 KMT2A (0.52) KMT2APTGS2PTGS1CYP2D6FAAH
SCHEMBL7651108 0.83 KMT2A (0.52) KMT2APTGS2PTGS1CYP2D6FAAH
SCHEMBL6922515 0.82 PTGS1 (0.72) KMT2APTGS2PTGS1CYP2D6ALOX5
SCHEMBL28393668 0.82 ESR1 (0.46) KMT2APTGS1CYP1A2CYP2D6SMN1; SMN2
SCHEMBL28308787 0.82 ESR1 (0.46) KMT2APTGS1CYP1A2CYP2D6SMN1; SMN2
SCHEMBL1000872 0.82 LMNA (0.40) PTGS2CYP1A2LMNAKDM4EL3MBTL1
SCHEMBL183940 0.81 KMT2A (0.67) KMT2APTGS2PTGS1LMNAL3MBTL1
SCHEMBL5544986 0.81 KMT2A (0.67) KMT2APTGS2PTGS1LMNAL3MBTL1

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-2452679-B1 TRIPRENYLPHENOLIC CYTOPROTECTIVE AGENT UNIV TOKYO NAT UNIV CORP (JP) 2014-05-28 EP disclosed