SCHEMBL8525955

SCHEMBL8525955

CC=Cc1cc(C(CC)c2ccc(OS(=O)(=O)c3ccccc3)c(C=CC)c2)ccc1OS(=O)(=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.46
MAPT P10636 7/20 0.44
KMT2A Q03164 6/20 0.44
GAA P10253 5/20 0.44
TDP1 Q9NUW8 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
LMNA P02545 5/20 0.42
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
MEN1 O00255 4/20 0.39
KDM4E B2RXH2 3/20 0.39
HPGD P15428 1/20 0.39
PKM P14618 1/20 0.37
NPSR1 Q6W5P4 2/20 0.37
MAPK1 P28482 2/20 0.36
ALPL P05186 1/20 0.36
THRB P10828 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL8499836 0.86 ALDH1A1 (0.47) ALDH1A1MAPTKMT2AGAATDP1
SCHEMBL3843557 0.81 ALDH1A1 (0.49) ALDH1A1MAPTKMT2AGAASMN1; SMN2
SCHEMBL3843556 0.81 ALDH1A1 (0.49) ALDH1A1MAPTKMT2AGAASMN1; SMN2
SCHEMBL8502386 0.80 ALDH1A1 (0.51) ALDH1A1MAPTKMT2AGAATDP1
SCHEMBL8502385 0.80 ALDH1A1 (0.51) ALDH1A1MAPTKMT2AGAATDP1
SCHEMBL7465006 0.80 ALDH1A1 (0.41) ALDH1A1MAPTKMT2AGAATDP1
SCHEMBL8502131 0.80 LMNA (0.47) ALDH1A1MAPTKMT2AGAATDP1
SCHEMBL3841082 0.77 ALDH1A1 (0.48) ALDH1A1MAPTKMT2AGAASMN1; SMN2
SCHEMBL3841089 0.77 ALDH1A1 (0.48) ALDH1A1MAPTKMT2AGAASMN1; SMN2
SCHEMBL3844717 0.76 ALDH1A1 (0.47) ALDH1A1MAPTKMT2AGAATDP1

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