SCHEMBL4629581

SCHEMBL4629581

C=COCOc1ccc(C(C)(C=O)c2ccc(OCOC=C)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.37
ALDH1A1 P00352 5/20 0.36
KDM4E B2RXH2 4/20 0.36
GAA P10253 1/20 0.36
TSHR P16473 3/20 0.33
LMNA P02545 1/20 0.33
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
MAOB P27338 1/20 0.32
AOC3 Q16853 1/20 0.32
NR4A2 P43354 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
TP53 P04637 2/20 0.32
MAPT P10636 2/20 0.32
HPGD P15428 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
APP P05067 1/20 0.32
PPARG P37231 1/20 0.32

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
SCHEMBL1506473 0.84 ALDH1A1 (0.45) SMN1; SMN2ALDH1A1KDM4EGAATSHR
SCHEMBL12892742 0.80 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1KDM4EGAATSHR
SCHEMBL7180242 0.80 NQO1 (0.38) SMN1; SMN2ALDH1A1TSHRAOC3TP53
SCHEMBL14845466 0.74 L3MBTL1 (0.39) SMN1; SMN2ALDH1A1GAALMNANR4A2
SCHEMBL8373718 0.71 CHRNA7 (0.47) ALDH1A1KDM4EGAATSHRKMT2A
SCHEMBL9279857 0.70 KMT2A (0.41) SMN1; SMN2KDM4ELMNAKMT2AMEN1
SCHEMBL5707376 0.70 KCNA3 (0.46) SMN1; SMN2ALDH1A1KDM4EGAALMNA
SCHEMBL12154686 0.69 MMP2 (0.35) SMN1; SMN2ALDH1A1KDM4ETSHRTP53
SCHEMBL905336 0.69 KDM4E (0.41) SMN1; SMN2ALDH1A1KDM4EGAAKMT2A
SCHEMBL11789508 0.69 KDM4E (0.49) SMN1; SMN2ALDH1A1KDM4EGAALMNA

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-1621338-B1 Lithographic printing plate precursor and lithographic printing method FUJIFILM CORP (JP) 2008-05-07 EP disclosed