SCHEMBL8502385

SCHEMBL8502385

C/C=C\c1cc(C)ccc1OS(=O)(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.51
LMNA P02545 5/20 0.50
MAPK1 P28482 1/20 0.49
MAPT P10636 8/20 0.44
MEN1 O00255 8/20 0.44
KMT2A Q03164 8/20 0.44
NPSR1 Q6W5P4 3/20 0.44
PKM P14618 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
GAA P10253 2/20 0.43
HTT P42858 2/20 0.42
RAB9A P51151 2/20 0.42
TP53 P04637 1/20 0.42
NPC1 O15118 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALPL P05186 1/20 0.41
GFER P55789 1/20 0.40
HPGD P15428 1/20 0.39
L3MBTL1 Q9Y468 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
SCHEMBL8502386 1.00 ALDH1A1 (0.51) ALDH1A1LMNAMAPK1MAPTMEN1
SCHEMBL3843556 0.83 ALDH1A1 (0.49) ALDH1A1LMNAMAPK1MAPTMEN1
SCHEMBL3843557 0.83 ALDH1A1 (0.49) ALDH1A1LMNAMAPK1MAPTMEN1
SCHEMBL8502131 0.82 LMNA (0.47) ALDH1A1LMNAMAPK1MAPTMEN1
SCHEMBL3846209 0.82 LMNA (0.47) ALDH1A1LMNAMAPK1MAPTMEN1
SCHEMBL3841082 0.82 ALDH1A1 (0.48) ALDH1A1LMNAMAPK1MAPTMEN1
SCHEMBL3841089 0.82 ALDH1A1 (0.48) ALDH1A1LMNAMAPK1MAPTMEN1
SCHEMBL3844718 0.81 ALDH1A1 (0.47) ALDH1A1LMNAMAPK1MAPTMEN1
SCHEMBL3844717 0.81 ALDH1A1 (0.47) ALDH1A1LMNAMAPK1MAPTMEN1
SCHEMBL8499836 0.81 ALDH1A1 (0.47) ALDH1A1LMNAMAPK1MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0956312-A1 PROCESS FOR PRODUCING PHENYLENE-CONTAINING POLYMER AND FILM-FORMING MATERIAL JSR Corporation (JP) 1999-11-17 EP disclosed
WO-1998033836-A1 PROCESS FOR PRODUCING PHENYLENE-CONTAINING POLYMER AND FILM-FORMING MATERIAL JSR CORPORATION (JP) 1998-08-06 WO disclosed