SCHEMBL61217

SCHEMBL61217

O=CON(Cc1ccc2c(c1)CN(C1CCC(=O)NC1=O)C2=O)C(=O)Nc1cccc(CN2CCOCC2)c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 8/20 0.49
TNF P01375 5/20 0.49
IKZF1 Q13422 4/20 0.49
IL1B P01584 3/20 0.49
DDB1 Q16531 2/20 0.49
IKZF3 Q9UKT9 2/20 0.49
GSPT1 P15170 3/20 0.47
CSNK1A1 P48729 4/20 0.47
IKZF2 Q9UKS7 7/20 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
Formic Acid SCHEMBL61216 0.85 CRBN (0.64) CRBNTNFIKZF1IL1BDDB1
SCHEMBL60982 0.84 CRBN (0.66) CRBNTNFIKZF1IL1BDDB1
SCHEMBL23240107 0.79 CRBN (0.58) CRBNTNFIKZF1IL1BDDB1
SCHEMBL62335 0.78 CRBN (0.69) CRBNIKZF1DDB1IKZF3GSPT1
SCHEMBL68283 0.78 CRBN (0.55) CRBNTNFIKZF1IL1BDDB1
SCHEMBL62299 0.78 CRBN (0.55) CRBNTNFIKZF1IL1BDDB1
SCHEMBL62428 0.77 CRBN (0.72) CRBNTNFIKZF1IL1BDDB1
SCHEMBL17495173 0.77 CRBN (0.52) CRBNTNFIKZF1IL1BDDB1
SCHEMBL29375205 0.75 CRBN (0.68) CRBNTNFIKZF1IL1BDDB1
SCHEMBL17420449 0.75 CRBN (0.68) CRBNTNFIKZF1IL1BDDB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3354646-A1 ISOINDOLINE COMPOUNDS FOR USE IN THE TREATMENT OF CANCER Celgene Corporation (US) 2018-08-01 EP disclosed
EP-2985281-B1 ISOINDOLINE COMPOUNDS FOR USE IN THE TREATMENT OF CANCER CELGENE CORP (US) 2017-12-27 EP disclosed
US-9796698-B2 Isoindoline compounds and methods of their use CELGENE CORPORATION (US) 2017-10-24 US disclosed
US-20170088538-A1 ISOINDOLINE COMPOUNDS AND METHODS OF THEIR USE CELGENE CORPORATION 2017-03-30 US disclosed
US-9550766-B2 Isoindoline compounds and methods of their use CELGENE CORPORATION (US) 2017-01-24 US disclosed
US-20160115161-A1 ISOINDOLINE COMPOUNDS AND METHODS OF THEIR USE CELGENE CORPORATION 2016-04-28 US disclosed
EP-2985281-A2 ISOINDOLINE COMPOUNDS FOR USE IN THE TREATMENT OF CANCER Celgene Corporation (US) 2016-02-17 EP disclosed
US-9227954-B2 Isoindoline compounds and methods of their use CELGENE CORPORATION (US) 2016-01-05 US disclosed
US-20130045976-A1 ISOINDOLINE COMPOUNDS AND METHODS OF THEIR USE CELGENE CORPORATION (US) 2013-02-21 US disclosed
US-8318773-B2 Isoindoline compounds and methods of their use CELGENE CORPORATION (US) 2012-11-27 US disclosed
US-20120252843-A1 ISOINDOLINE COMPOUNDS AND METHODS OF THEIR USE CELGENE CORPORATION 2012-10-04 US disclosed
US-8222249-B2 Isoindoline compounds and methods of their use CELGENE CORPORATION (US) 2012-07-17 US disclosed
US-20120122865-A1 ISOINDOLINE COMPOUNDS AND METHODS OF THEIR USE CELGENE CORPORATION 2012-05-17 US disclosed
US-8129375-B2 Isoindoline compounds and methods of their use CELGENE CORPORATION (US) 2012-03-06 US disclosed
US-20100204227-A1 ISOINDOLINE COMPOUNDS AND METHODS OF THEIR USE CELGENE CORPORATION 2010-08-12 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 (6 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-20170088538-A1 ISOINDOLINE COMPOUNDS AND METHODS OF THEIR USE CPT1A, CYP11B2, NPC1 CRBN 4221/4885TNF 3205/4885IKZF1 2242/4885
US-20100204227-A1 ISOINDOLINE COMPOUNDS AND METHODS OF THEIR USE CPT1A, CYP11B2, NPC1 CRBN 4221/4885TNF 3205/4885IKZF1 2242/4885
US-20120252843-A1 ISOINDOLINE COMPOUNDS AND METHODS OF THEIR USE CPT1A, CYP11B2, NPC1 CRBN 4221/4885TNF 3205/4885IKZF1 2242/4885
US-20120122865-A1 ISOINDOLINE COMPOUNDS AND METHODS OF THEIR USE CPT1A, CYP11B2, NPC1 CRBN 4221/4885TNF 3205/4885IKZF1 2242/4885
US-20130045976-A1 ISOINDOLINE COMPOUNDS AND METHODS OF THEIR USE CPT1A, CYP11B2, NPC1 CRBN 4221/4885TNF 3205/4885IKZF1 2242/4885
US-20160115161-A1 ISOINDOLINE COMPOUNDS AND METHODS OF THEIR USE CPT1A, CYP11B2, NPC1 CRBN 4221/4885TNF 3205/4885IKZF1 2242/4885

“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.