SCHEMBL7223574

SCHEMBL7223574

O=C(O)c1ccc(C(=O)Nc2cc(C(=O)Nc3cccc4cc(S(=O)(=O)O)ccc34)cc(C(=O)Nc3cccc4cc(S(=O)(=O)O)ccc34)c2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGF1 P05230 1/20 0.60
CASP6 P55212 2/20 0.58
TIMP3 P35625 2/20 0.53
CYP2C9 P11712 2/20 0.47
CYP2C19 P33261 2/20 0.47
NPC1 O15118 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
RAB9A P51151 1/20 0.47
HSD17B10 Q99714 2/20 0.47
ATIC P31939 1/20 0.47
CTDSP1 Q9GZU7 1/20 0.47
APEX1 P27695 1/20 0.46
PKM P14618 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
RHOA P61586 1/20 0.45
POLB P06746 1/20 0.44

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
SCHEMBL7224393 0.93 CASP6 (0.58) FGF1CASP6TIMP3CYP2C9CYP2C19
SCHEMBL7233377 0.93 CASP6 (0.60) FGF1CASP6TIMP3CYP2C9CYP2C19
SCHEMBL6243020 0.91 CASP6 (0.66) FGF1CASP6TIMP3CYP2C9CYP2C19
SCHEMBL7230621 0.90 CASP6 (0.60) FGF1CASP6TIMP3CYP2C9CYP2C19
SCHEMBL7233109 0.90 FGF1 (0.59) FGF1CASP6TIMP3CYP2C9CYP2C19
SCHEMBL7232290 0.90 FGF1 (0.59) FGF1CASP6TIMP3CYP2C9CYP2C19
SCHEMBL7224663 0.88 CASP6 (0.55) FGF1CASP6TIMP3CYP2C9CYP2C19
SCHEMBL6240628 0.88 CASP6 (0.72) FGF1CASP6TIMP3CYP2C9CYP2C19
SCHEMBL7224369 0.88 CASP6 (0.57) FGF1CASP6TIMP3NPC1RAB9A
SCHEMBL7230329 0.88 CASP6 (0.57) FGF1CASP6TIMP3CYP2C9CYP2C19

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
US-6653321-B1 Stimulating kinase activity of insulin receptor; type II diabetes; hyperglycemia TELIK, INC. 2003-11-25 US disclosed
EP-1200396-A1 NAPHTHYLSULFONIC ACIDS AND RELATED COMPOUNDS AS GLUCOSE UPTAKE AGONISTS TELIK, INC. (US) 2002-05-02 EP disclosed
WO-2001012591-A1 NOVEL NAPHTHYLSULFONIC ACIDS AND RELATED COMPOUNDS AS GLUCOSE UPTAKE AGONISTS TELIK, INC. (US) 2001-02-22 WO disclosed