SCHEMBL8303404

SCHEMBL8303404

CN(C(=O)CN1C(=O)c2ccccc2C1=O)c1ccc(C(Cl)OS(C)(=O)=O)cc1C(Cl)OS(C)(=O)=O

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
POLB P06746 1/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 2/20 0.35
MAPT P10636 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
ELANE P08246 1/20 0.35
RECQL P46063 1/20 0.35
CA12 O43570 1/20 0.34
CA9 Q16790 1/20 0.34

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
SCHEMBL8801762 0.87 GAA (0.40) GAATDP1POLBKMT2AMEN1
SCHEMBL7981672 0.81 POLB (0.41) GAATDP1POLBKMT2AMEN1
SCHEMBL8802909 0.77 GAA (0.39) GAATDP1POLBKMT2AMEN1
SCHEMBL8803622 0.77 ELANE (0.43) GAATDP1POLBKMT2AMEN1
SCHEMBL7747088 0.71 GAA (0.43) GAATDP1POLBKMT2AMEN1
SCHEMBL6964596 0.70 GAA (0.40) GAATDP1POLBKMT2AMEN1
SCHEMBL6644197 0.69 GAA (0.40) GAATDP1POLBKMT2AMEN1
SCHEMBL29472256 0.68 GAA (0.46) GAATDP1POLBKMT2AMEN1
SCHEMBL22311488 0.68 GAA (0.46) GAATDP1POLBKMT2AMEN1
SCHEMBL29398039 0.67 L3MBTL1 (0.63) GAATDP1POLBKMT2AMEN1

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-0900203-A1 QUINOLINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION, AND THEIR USE AS MEDICAMENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-03-10 EP disclosed
WO-1997041104-A1 QUINOLINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION, AND THEIR USE AS MEDICAMENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-11-06 WO disclosed