SCHEMBL7554741

SCHEMBL7554741

CCCCN(CCCC)CCCC.CCCCN(CCCC)CCCC.Nc1ccc(Oc2ccc(N)cc2S(=O)(=O)O)c(S(=O)(=O)O)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.45
CYP1A2 P05177 2/20 0.45
CYP2D6 P10635 2/20 0.45
SCN1A P35498 2/20 0.45
SCN2A Q99250 2/20 0.45
SCN3A Q9NY46 2/20 0.45
LMNA P02545 1/20 0.45
CHRM2 P08172 1/20 0.45
CYP3A4 P08684 1/20 0.45
HTR1A P08908 1/20 0.45
DRD3 P35462 1/20 0.45
SLC6A3 Q01959 1/20 0.45
KCNH2 Q12809 1/20 0.45
HSD17B10 Q99714 2/20 0.43
MAPT P10636 7/20 0.41
RAPGEF4 Q8WZA2 1/20 0.38
POLB P06746 5/20 0.37
KDM4E B2RXH2 5/20 0.37
ALDH1A1 P00352 5/20 0.37
L3MBTL1 Q9Y468 4/20 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
SCHEMBL7557045 0.96 HSD17B10 (0.42) GAACYP1A2CYP2D6SCN1ASCN2A
SCHEMBL7551904 0.92 LMNA (0.44) GAACYP1A2CYP2D6SCN1ASCN2A
SCHEMBL7555732 0.89 LMNA (0.41) GAACYP1A2CYP2D6SCN1ASCN2A
SCHEMBL7549551 0.86 HSD17B10 (0.46) GAACYP1A2CYP2D6SCN1ASCN2A
SCHEMBL7551655 0.85 GAA (0.45) GAACYP1A2CYP2D6SCN1ASCN2A
SCHEMBL7551464 0.85 GAA (0.45) GAACYP1A2CYP2D6SCN1ASCN2A
SCHEMBL7551649 0.85 GAA (0.45) GAACYP1A2CYP2D6SCN1ASCN2A
SCHEMBL7551470 0.85 GAA (0.45) GAACYP1A2CYP2D6SCN1ASCN2A
SCHEMBL7549857 0.83 GAA (0.46) GAACYP1A2CYP2D6SCN1ASCN2A
SCHEMBL7549851 0.83 GAA (0.46) GAACYP1A2CYP2D6SCN1ASCN2A

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-0747418-B1 Aromatic polyimide and gas separation UBE INDUSTRIES (JP) 2002-07-03 EP disclosed
EP-0747418-A1 Aromatic polyimide and gas separation UBE INDUSTRIES, LTD. (JP) 1996-12-11 EP disclosed