SCHEMBL9820165

SCHEMBL9820165

CO/C=C(/C(=O)OC)c1ccc(Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.55
KDM4E B2RXH2 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
TDP1 Q9NUW8 1/20 0.55
HPGD P15428 1/20 0.44
MAPT P10636 4/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
CES2 O00748 2/20 0.42
CES1 P23141 2/20 0.42
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 4/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
LMNA P02545 2/20 0.40
NFKB1 P19838 1/20 0.40
STAT1 P42224 1/20 0.40
NFKB2 Q00653 1/20 0.40

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
SCHEMBL9338252 1.00 SMN1; SMN2 (0.55) SMN1; SMN2KDM4EL3MBTL1TDP1HPGD
SCHEMBL9338251 1.00 SMN1; SMN2 (0.55) SMN1; SMN2KDM4EL3MBTL1TDP1HPGD
SCHEMBL9693162 0.92 SMN1; SMN2 (0.49) SMN1; SMN2KDM4EL3MBTL1TDP1MAPT
SCHEMBL9693160 0.92 SMN1; SMN2 (0.49) SMN1; SMN2KDM4EL3MBTL1TDP1MAPT
SCHEMBL9019998 0.84 CA1 (0.52) SMN1; SMN2KDM4EL3MBTL1TDP1HPGD
SCHEMBL7168869 0.84 AKR1C3 (0.50) SMN1; SMN2KDM4EL3MBTL1TDP1HPGD
SCHEMBL9019902 0.84 CA1 (0.47) SMN1; SMN2KDM4EL3MBTL1TDP1HPGD
SCHEMBL8653469 0.84 ALDH1A1 (0.53) SMN1; SMN2KDM4EL3MBTL1TDP1HPGD
SCHEMBL8958972 0.84 AKR1C3 (0.50) SMN1; SMN2KDM4EL3MBTL1TDP1HPGD
SCHEMBL9335995 0.84 SMN1; SMN2 (0.49) SMN1; SMN2KDM4EL3MBTL1TDP1HPGD

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-0178826-B1 FUNGICIDES ZENECA LIMITED (GB) 1991-12-18 EP disclosed