SCHEMBL1962641

SCHEMBL1962641

NCCC(=O)NCc1cccc2c1CN(C1CCC(=O)NC1=O)C2=O

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 14/20 0.69
CSNK1A1 P48729 3/20 0.69
IKZF1 Q13422 2/20 0.69
IKZF3 Q9UKT9 5/20 0.61
DDB1 Q16531 3/20 0.61
BRD4 O60885 2/20 0.61
TNF P01375 1/20 0.61
IL1B P01584 1/20 0.61
HDAC3 O15379 1/20 0.51
HDAC1 Q13547 1/20 0.51
MAP1LC3B Q9GZQ8 2/20 0.47
GSPT1 P15170 3/20 0.46
SALL4 Q9UJQ4 2/20 0.46
AXL P30530 1/20 0.45

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
Hydrochloric Acid SCHEMBL1963612 0.99 CRBN (0.68) CRBNCSNK1A1IKZF1IKZF3DDB1
SCHEMBL12554031 0.95 CRBN (0.66) CRBNCSNK1A1IKZF1IKZF3DDB1
Hydrochloric Acid SCHEMBL1964328 0.94 CRBN (0.65) CRBNCSNK1A1IKZF1IKZF3DDB1
SCHEMBL1962924 0.91 CRBN (0.68) CRBNCSNK1A1IKZF1IKZF3DDB1
SCHEMBL1964603 0.89 CRBN (0.70) CRBNCSNK1A1IKZF1IKZF3DDB1
SCHEMBL1961945 0.88 CRBN (0.64) CRBNCSNK1A1IKZF1IKZF3DDB1
SCHEMBL1963474 0.88 CRBN (0.74) CRBNCSNK1A1IKZF1IKZF3DDB1
SCHEMBL13716786 0.87 CRBN (0.73) CRBNCSNK1A1IKZF1IKZF3DDB1
SCHEMBL1963964 0.87 CRBN (0.67) CRBNCSNK1A1IKZF1IKZF3DDB1
SCHEMBL1963717 0.87 CRBN (0.67) CRBNCSNK1A1IKZF1IKZF3DDB1

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
US-20200113896-A1 METHODS FOR TREATING CANCER USING TOR KINASE INHIBITOR COMBINATION THERAPY SIGNAL PHARM LLC (US) 2020-04-16 US disclosed
US-20140314752-A1 METHODS FOR TREATING CANCER USING TOR KINASE INHIBITOR COMBINATION THERAPY SIGNAL PHARMACEUTICALS, LLC (US) 2014-10-23 US disclosed
US-20140314752-A1 METHODS FOR TREATING CANCER USING TOR KINASE INHIBITOR COMBINATION THERAPY SIGNAL PHARMACEUTICALS, LLC (US) 2014-10-23 US disclosed
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
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 (4 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-20200113896-A1 METHODS FOR TREATING CANCER USING TOR KINASE INHIBITOR COMBINATION THERAPY MTOR, ULK1, RICTOR CRBN 869/4885CSNK1A1 728/4885IKZF1 238/4885
US-20140314752-A1 METHODS FOR TREATING CANCER USING TOR KINASE INHIBITOR COMBINATION THERAPY MTOR, ULK1, RICTOR CRBN 869/4885CSNK1A1 728/4885IKZF1 238/4885
US-20110144158-A1 ISOINDOLE-IMIDE COMPOUNDS AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME SI, CYP3A5, CYP2D6 CRBN 2589/4885CSNK1A1 137/4885IKZF1 658/4885
US-20070049618-A1 Isoindole-imide compounds and compositions comprising and methods of using the same SI, CYP3A5, CYP2D6 CRBN 2589/4885CSNK1A1 137/4885IKZF1 658/4885

“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.