SCHEMBL9133136

SCHEMBL9133136

C=C(Cc1cccc(CC(=O)c2ccccc2)c1)C(=O)OCC

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.51
ALDH1A1 P00352 1/20 0.51
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
NPC1 O15118 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.41
SRD5A2 P31213 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
HRH2 P25021 1/20 0.40
HRH1 P35367 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
MRGPRX4 Q96LA9 1/20 0.39
POLB P06746 1/20 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
SCHEMBL394740 0.84 ALDH1A1 (0.56) MAPTALDH1A1KMT2AMEN1L3MBTL1
SCHEMBL22474491 0.81 CTBP2 (0.48) MAPTALDH1A1KMT2AMEN1NPC1
Dimethylamine SCHEMBL28428235 0.80 ALDH1A1 (0.51) MAPTALDH1A1KMT2AMEN1NPC1
SCHEMBL25400177 0.79 MAPT (0.47) MAPTALDH1A1KMT2AMEN1L3MBTL1
SCHEMBL5426625 0.79 EGFR (0.44) MAPTALDH1A1L3MBTL1
SCHEMBL10544357 0.79 XPO1 (0.52) MAPTALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL11633589 0.79 MAPT (0.60) MAPTALDH1A1KMT2AMEN1NPC1
SCHEMBL9873848 0.78 MAPT (0.61) MAPTALDH1A1KMT2AMEN1NPC1
SCHEMBL29846895 0.78 CTBP2 (0.51) MAPTALDH1A1KMT2AMEN1L3MBTL1
SCHEMBL7341455 0.78 CTBP2 (0.51) MAPTALDH1A1KMT2AMEN1L3MBTL1

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
US-5407666-A Photocurable composition containing film forming acrylate polymer, photoinitiator, reactive monomer, thickener, pigment INTERNATIONAL BEAUTY DESIGN, INC. (US) 1995-04-18 US disclosed