SCHEMBL2172601

SCHEMBL2172601

NC(=O)c1cc2ccccc2cc1C(=O)NC1CCC(=O)NC1=O

nearest known ligand 0.66

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 20/20 0.66
DDB1 Q16531 3/20 0.61
IKZF3 Q9UKT9 1/20 0.55
BRD4 O60885 2/20 0.52

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
SCHEMBL4778758 0.89 CRBN (0.66) CRBNDDB1IKZF3BRD4
SCHEMBL5496321 0.87 CRBN (0.76) CRBNDDB1IKZF3BRD4
SCHEMBL23812319 0.80 CRBN (0.69) CRBNDDB1IKZF3BRD4
SCHEMBL17169744 0.80 CRBN (1.00) CRBNDDB1IKZF3BRD4
SCHEMBL29923298 0.80 CRBN (1.00) CRBNDDB1IKZF3BRD4
Hydrochloric Acid SCHEMBL19359358 0.79 CRBN (0.97) CRBNDDB1IKZF3BRD4
SCHEMBL4778728 0.78 CRBN (0.74) CRBNDDB1IKZF3BRD4
SCHEMBL20811963 0.78 CRBN (0.74) CRBNDDB1IKZF3BRD4
SCHEMBL26646479 0.78 CRBN (0.77) CRBNDDB1IKZF3BRD4
SCHEMBL20812494 0.77 CRBN (0.67) CRBNDDB1IKZF3BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2007505922-A 2007-03-15 JP claimed
CN-1867331-A Thalidomide analogs as TNF-alpha modulators US GOV HEALTH & HUMAN SERV (US) 2006-11-22 CN claimed
US-20060211728-A1 Thalidomide analogs P2D INC. 2006-09-21 US claimed
EP-1663223-A2 THALIDOMIDE ANALOGS AS TNF-ALPHA MODULATORS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, represented by THE DEPARTMENT OF HEALTH & HUMAN SERVICES (US) 2006-06-07 EP claimed
WO-2005028436-A2 THALIDOMIDE ANALOGS AS TNF-ALPHA MODULATORS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2005-03-31 WO claimed
US-20140309436-A1 THALIDOMIDE ANALOGS P2D, INC. 2014-10-16 US disclosed
US-8853253-B2 Thalidomide analogs P2D, INC. (US) 2014-10-07 US disclosed
US-8546430-B2 Thalidomide analogs P2D, INC. (US) 2013-10-01 US disclosed
US-20130035363-A1 Thalidomide Analogs THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH & HUMAN SERVICES (US) 2013-02-07 US disclosed
US-20110245210-A1 THALIDOMIDE ANALOGS The Government of the United States of America, as represented by the Secretary of 2011-10-06 US disclosed
US-7973057-B2 Thalidomide analogs THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2011-07-05 US disclosed
CN-1867331-B Thalidomide analogs as TNF-alpha modulators US GOV HEALTH & HUMAN SERV (US) 2010-05-26 CN disclosed
CN-1867331-A Thalidomide analogs as TNF-alpha modulators US GOV HEALTH & HUMAN SERV (US) 2006-11-22 CN disclosed
US-20060211728-A1 Thalidomide analogs P2D INC. 2006-09-21 US disclosed
EP-1663223-A2 THALIDOMIDE ANALOGS AS TNF-ALPHA MODULATORS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, represented by THE DEPARTMENT OF HEALTH & HUMAN SERVICES (US) 2006-06-07 EP disclosed
WO-2005028436-A2 THALIDOMIDE ANALOGS AS TNF-ALPHA MODULATORS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2005-03-31 WO 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-20130035363-A1 Thalidomide Analogs TNF, TNFRSF1A, TNFRSF9 CRBN 241/4885DDB1 919/4885IKZF3 949/4885
US-20060211728-A1 Thalidomide analogs TNF, TNFRSF1A, PGF CRBN 321/4885DDB1 953/4885IKZF3 854/4885
US-20140309436-A1 THALIDOMIDE ANALOGS TNF, TNFRSF1A, TNFRSF9 CRBN 241/4885DDB1 919/4885IKZF3 949/4885
US-20110245210-A1 THALIDOMIDE ANALOGS TNF, TNFRSF1A, PGF CRBN 321/4885DDB1 953/4885IKZF3 854/4885

“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.