SCHEMBL8445104

SCHEMBL8445104

CCCCCCCCCCCCCCCCNc1ccc(C(C)=O)c(O)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNLIP P16233 2/20 0.55
NAAA Q02083 2/20 0.49
ABL1 P00519 1/20 0.48
PLK1 P53350 3/20 0.47
EGFR P00533 2/20 0.47
SYK P43405 1/20 0.47
ALOX5 P09917 1/20 0.47
PTGS2 P35354 1/20 0.47
BCL2L1 Q07817 1/20 0.47
MCL1 Q07820 1/20 0.47
POLB P06746 1/20 0.46
PPARA Q07869 1/20 0.44
HPGD P15428 3/20 0.44
ALDH1A1 P00352 2/20 0.44
CYP3A4 P08684 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.43
LMNA P02545 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
F2R P25116 1/20 0.43

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
SCHEMBL8443115 0.88 EGFR (0.56) PNLIPNAAAABL1PLK1EGFR
SCHEMBL10970233 0.87 BCL2L1 (0.61) PNLIPNAAAABL1PLK1EGFR
SCHEMBL17965862 0.82 ALOX5 (0.54) PNLIPNAAAEGFRSYKALOX5
SCHEMBL9484979 0.81 ABL1 (0.55) PNLIPNAAAABL1EGFRSYK
SCHEMBL9768522 0.80 ALDH1A1 (0.62) EGFRPOLBHPGDALDH1A1LMNA
Sulfuric Acid SCHEMBL3632619 0.80 BCL2L1 (0.57) PNLIPPLK1BCL2L1MCL1PPARA
SCHEMBL10759621 0.79 KAT8 (0.58) NAAAPLK1EGFRSYKALOX5
SCHEMBL11318599 0.79 PLK1 (0.58) NAAAABL1PLK1EGFRSYK
SCHEMBL11307721 0.79 PLK1 (0.58) NAAAABL1PLK1EGFRSYK
SCHEMBL11316566 0.79 PLK1 (0.58) NAAAABL1PLK1EGFRSYK

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0929557-A2 (o-ACYL-p-N-ACYLAMINO-PHENYL)-O-PHOSPHOETHANOLAMINES CLARION PHARMACEUTICALS, INC. (US) 1999-07-21 EP disclosed
WO-1998014454-A2 (o-ACYL-p-N-ACYLAMINO-PHENYL)-O-PHOSPHOETHANOLAMINES CLARION PHARMACEUTICALS, INC. (US) 1998-04-09 WO disclosed
US-5661138-A ANTIINFLAMMATORY AGENTS; THE ALKYL GROUP OF THE N-ACYLAMINO GROUP HAVING 9-23 CARBON ATOMS CLARION PHARMACEUTICAL, INC. (US) 1997-08-26 US disclosed