SCHEMBL1964145

SCHEMBL1964145

O=C(O)c1cccc(Nc2ccc3c(c2)OCO3)c1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK9 P45984 1/20 0.53
MAPK10 P53779 1/20 0.53
FABP3 P05413 1/20 0.52
FABP4 P15090 1/20 0.52
FABP5 Q01469 1/20 0.52
NPC1 O15118 11/20 0.51
RAB9A P51151 11/20 0.51
PAX8 Q06710 1/20 0.51
KLF5 Q13887 1/20 0.51
TOP1 P11387 1/20 0.49
PTGS2 P35354 1/20 0.49
GRIK1 P39086 1/20 0.49
SMN1; SMN2 Q16637 5/20 0.49
TP53 P04637 2/20 0.49
MEN1 O00255 5/20 0.49
KMT2A Q03164 5/20 0.49
POLB P06746 2/20 0.49
MAPT P10636 6/20 0.48
HPGD P15428 1/20 0.48
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL15178350 0.91 MAPK9 (0.50) MAPK9MAPK10FABP3FABP4FABP5
SCHEMBL9709264 0.86 NPC1 (0.64) MAPK9MAPK10NPC1RAB9APAX8
SCHEMBL1962230 0.81 RAB9A (0.53) MAPK9MAPK10NPC1RAB9ATOP1
SCHEMBL4227799 0.77 GRIK1 (0.53) MAPK9MAPK10FABP3FABP4FABP5
SCHEMBL1920761 0.76 NPC1 (0.54) MAPK9MAPK10NPC1RAB9APTGS2
SCHEMBL4212903 0.76 MEN1 (0.51) MAPK9MAPK10FABP3FABP4FABP5
SCHEMBL1962364 0.75 POLB (0.53) MAPK9MAPK10FABP3FABP4FABP5
SCHEMBL12700201 0.75 NPC1 (0.75) NPC1RAB9ASMN1; SMN2TP53MEN1
SCHEMBL4213800 0.75 CASP3 (0.59) MAPK9MAPK10FABP3FABP4FABP5
SCHEMBL4220093 0.75 GRIK1 (0.59) FABP3FABP4FABP5NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1919892-B1 ISOINDOLE-IMIDE COMPOUNDS AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME CELGENE CORP (US) 2013-08-14 EP disclosed
US-8481568-B2 Isoindole-imide compounds and compositions comprising and methods of using the same CELGENE CORPORATION (US) 2013-07-09 US disclosed
US-8481568-B2 Isoindole-imide compounds and compositions comprising and methods of using the same CELGENE CORPORATION (US) 2013-07-09 US disclosed
US-8481568-B2 Isoindole-imide compounds and compositions comprising and methods of using the same CELGENE CORPORATION (US) 2013-07-09 US disclosed
US-20110144158-A1 ISOINDOLE-IMIDE COMPOUNDS AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME SEPRACOR INC. 2011-06-16 US disclosed
US-20110144158-A1 ISOINDOLE-IMIDE COMPOUNDS AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME SEPRACOR INC. 2011-06-16 US disclosed
US-20110144158-A1 ISOINDOLE-IMIDE COMPOUNDS AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME SEPRACOR INC. 2011-06-16 US disclosed
CN-101291924-A Isoindole-imide compounds and compositions comprising and methods of using the same CELGENE CORP (US) 2008-10-22 CN disclosed
EP-1919892-A2 ISOINDOLE-IMIDE COMPOUNDS AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME CELGENE CORPORATION (US) 2008-05-14 EP disclosed
WO-2007027527-A2 ISOINDOLE-IMIDE COMPOUNDS AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME CELGENE CORPORATION (US) 2007-03-08 WO disclosed
US-20070049618-A1 Isoindole-imide compounds and compositions comprising and methods of using the same CELGENE CORPORATION 2007-03-01 US disclosed
US-20070049618-A1 Isoindole-imide compounds and compositions comprising and methods of using the same CELGENE CORPORATION 2007-03-01 US disclosed
US-20070049618-A1 Isoindole-imide compounds and compositions comprising and methods of using the same CELGENE CORPORATION 2007-03-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110144158-A1 ISOINDOLE-IMIDE COMPOUNDS AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME SI, CYP3A5, CYP2D6 MAPK9 4236/4885MAPK10 4352/4885FABP3 3811/4885
US-20070049618-A1 Isoindole-imide compounds and compositions comprising and methods of using the same SI, CYP3A5, CYP2D6 MAPK9 4236/4885MAPK10 4352/4885FABP3 3811/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.