SCHEMBL8501868

SCHEMBL8501868

CCC(c1ccc(OS(=O)(=O)c2ccccc2)cc1)c1ccc(OS(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 5/20 0.57
MAPT P10636 4/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 4/20 0.48
ALDH1A1 P00352 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
GAA P10253 2/20 0.47
MAPK1 P28482 1/20 0.47
MAOB P27338 2/20 0.46
ADAMTS4 O75173 1/20 0.45
HTT P42858 2/20 0.43
LMNA P02545 1/20 0.43
CA12 O43570 2/20 0.43
CA2 P00918 2/20 0.43
EGFR P00533 1/20 0.42
KMT2A Q03164 2/20 0.42
ENPP3 O14638 4/20 0.42
ENPP1 P22413 4/20 0.42
PSIP1 O75475 1/20 0.41

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
SCHEMBL1826030 0.98 TDP1 (0.56) TDP1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL1824280 0.90 ALDH1A1 (0.51) TDP1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL1825104 0.87 TDP1 (0.54) TDP1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL1821343 0.83 TDP1 (0.50) TDP1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL1827082 0.81 TDP1 (0.51) TDP1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL1826108 0.81 TDP1 (0.59) TDP1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL1821528 0.81 FFAR1 (0.42) LMNACA12CA2KMT2A
SCHEMBL3838524 0.81 TDP1 (0.62) TDP1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL26317205 0.81 TDP1 (0.46) TDP1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL1825604 0.80 TDP1 (0.57) TDP1MAPTNPC1RAB9ASMN1; SMN2

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