SCHEMBL6472934

SCHEMBL6472934

C/C(C(=O)O)=C(\c1ccccc1)C(C)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
LMNA P02545 2/20 0.44
XBP1 P17861 1/20 0.44
ATM Q13315 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
CES1 P23141 4/20 0.42
CES2 O00748 3/20 0.42
ALDH1A1 P00352 4/20 0.40
CYP3A4 P08684 3/20 0.40
KDM4E B2RXH2 3/20 0.39
KMT2A Q03164 3/20 0.39
HPGD P15428 2/20 0.39
MAPK1 P28482 2/20 0.39
MEN1 O00255 2/20 0.39
ALOX15 P16050 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PTGS1 P23219 2/20 0.39
CXCR1 P25024 2/20 0.39
CXCR2 P25025 2/20 0.39

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
SCHEMBL6472265 0.84 CES1 (0.45) MAPTSMN1; SMN2LMNAXBP1ATM
SCHEMBL8850427 0.84 MAPT (0.53) MAPTSMN1; SMN2LMNAXBP1ATM
SCHEMBL16697813 0.81 CES1 (0.42) MAPTSMN1; SMN2LMNAXBP1ATM
SCHEMBL8823334 0.73 KMT2A (0.55) MAPTSMN1; SMN2LMNAXBP1ATM
SCHEMBL649287 0.73 KMT2A (0.55) MAPTSMN1; SMN2LMNAXBP1ATM
SCHEMBL1173261 0.72 PGR (0.43) MAPTSMN1; SMN2LMNAXBP1ATM
SCHEMBL1232452 0.72 CES1 (0.54) MAPTSMN1; SMN2LMNACES1CES2
SCHEMBL367453 0.72 CES1 (0.54) MAPTSMN1; SMN2LMNACES1CES2
SCHEMBL367456 0.72 CES1 (0.54) MAPTSMN1; SMN2LMNACES1CES2
SCHEMBL6720578 0.72 MAPT (0.40) MAPTSMN1; SMN2LMNAXBP1ATM

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
WO-2005016983-A1 COATING SYSTEM CONTAINING (METH)ACRYLATE SIKA TECHNOLOGY AG (CH) 2005-02-24 WO disclosed