SCHEMBL7550180

SCHEMBL7550180

CCCCN(CCCC)CCCC.CCCCN(CCCC)CCCC.Nc1ccc(Cc2ccc(N)c(S(=O)(=O)O)c2)cc1S(=O)(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.42
CTDSP1 Q9GZU7 1/20 0.40
POLB P06746 2/20 0.39
RECQL P46063 1/20 0.39
ESR2 Q92731 1/20 0.39
GAA P10253 3/20 0.37
DRD3 P35462 2/20 0.37
CYP3A4 P08684 2/20 0.37
THRA P10827 1/20 0.37
THRB P10828 1/20 0.37
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
CHRM2 P08172 1/20 0.37
HTR1A P08908 1/20 0.37
CYP2D6 P10635 1/20 0.37
SCN1A P35498 1/20 0.37
SLC6A3 Q01959 1/20 0.37
KCNH2 Q12809 1/20 0.37
SCN2A Q99250 1/20 0.37
SCN3A Q9NY46 1/20 0.37

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
SCHEMBL7555699 0.96 CTDSP1 (0.40) MAPTCTDSP1POLBRECQLESR2
SCHEMBL7551649 0.86 GAA (0.45) MAPTCTDSP1POLBRECQLGAA
SCHEMBL7551655 0.86 GAA (0.45) MAPTCTDSP1POLBRECQLGAA
SCHEMBL7550164 0.85 CTDSP1 (0.44) MAPTCTDSP1POLBRECQLESR2
Trimethylammonium SCHEMBL7550558 0.84 POLB (0.44) MAPTCTDSP1POLBRECQLESR2
SCHEMBL7551141 0.83 CTDSP1 (0.40) MAPTCTDSP1POLBGAADRD3
SCHEMBL8400669 0.83 GAA (0.50) MAPTCTDSP1POLBRECQLESR2
SCHEMBL7550395 0.82 DRD3 (0.39) MAPTCTDSP1POLBGAADRD3
SCHEMBL7550387 0.82 DRD3 (0.39) MAPTCTDSP1POLBGAADRD3
Ammonia Solution, Strong SCHEMBL7547968 0.82 GAA (0.48) MAPTCTDSP1POLBRECQLESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0747418-B1 Aromatic polyimide and gas separation UBE INDUSTRIES (JP) 2002-07-03 EP disclosed
US-5744575-A Aromatic polyimide and gas separation UBE INDUSTRIES, LTD. (JP) 1998-04-28 US disclosed
EP-0747418-A1 Aromatic polyimide and gas separation UBE INDUSTRIES, LTD. (JP) 1996-12-11 EP disclosed