SCHEMBL3744126

SCHEMBL3744126

Cc1cccc2c1C(=O)N(C1(F)CC(O)C(=O)NC1=O)C2=O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 4/20 0.44
CRBN Q96SW2 4/20 0.44
TYMS P04818 4/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
DPP4 P27487 1/20 0.35
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL3739793 0.89 DDB1 (0.43) DDB1CRBNDPP4KDM4EALDH1A1
SCHEMBL3744633 0.86 DDB1 (0.38) DDB1CRBNKDM4EALDH1A1
SCHEMBL3748553 0.84 DDB1 (0.47) DDB1CRBNTYMSCA1CA2
SCHEMBL3749207 0.83 DDB1 (0.52) DDB1CRBNKDM4EALDH1A1
SCHEMBL3738114 0.81 DDB1 (0.47) DDB1CRBNCA1CA2CA7
SCHEMBL3755200 0.79 HTR2A (0.36) DDB1CRBN
SCHEMBL3754054 0.78 DDB1 (0.53) DDB1CRBNKDM4EALDH1A1
SCHEMBL5958867 0.76 DDB1 (0.52) DDB1CRBNDPP4
SCHEMBL23065970 0.75 DDB1 (0.40) DDB1CRBNTYMSCA1CA2
SCHEMBL3745339 0.74 DDB1 (0.47) DDB1CRBNDPP4KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7834033-B2 Methods for treating cancer using 3-[1,3dioxo-4-benzamidoisoindolin-2-yl]-2,6-dioxo-5-hydroxypiperidine CELGENE CORPORATION (US) 2010-11-16 US disclosed
EP-1341537-B1 PHARMACEUTICALLY ACTIVE ISOINDOLINE DERIVATIVES CELGENE CORP (US) 2007-01-24 EP disclosed
EP-1733726-A1 Pharmaceutically active isoindoline derivatives Celgene Corporation (US) 2006-12-20 EP disclosed
US-20060069126-A1 Pharmaceutically active isoindoline derivatives CELGENE CORPORATION 2006-03-30 US disclosed
US-7005438-B2 Pharmaceutically active isoindoline derivatives CELGENE CORPORATION (US) 2006-02-28 US disclosed
US-6762195-B2 TREATING DISEASES MEDIATED BY TUMOR NECROSIS FACTOR; INHIBIT ANGIOGENESIS AND TREATMENT OF CANCER, INFLAMMATORY, AND AUTOIMMUNE DISEASES CELGENE CORPORATION 2004-07-13 US disclosed
US-20040122052-A1 Pharmaceutically active isoindoline derivatives CELGENE CORPORATION 2004-06-24 US disclosed
EP-1341537-A4 PHARMACEUTICALLY ACTIVE ISOINDOLINE DERIVATIVES CELGENE CORP (US) 2004-01-28 EP disclosed
EP-1341537-A2 PHARMACEUTICALLY ACTIVE ISOINDOLINE DERIVATIVES CELGENE CORPORATION (US) 2003-09-10 EP disclosed
US-20030069428-A1 Pharmaceutically active isoindoline derivatives MULLER GEORGE 2003-04-10 US disclosed
WO-2002094180-A2 PHARMACEUTICALLY ACTIVE ISOINDOLINE DERIVATIVES CELGENE CORPORATION (US) 2002-11-28 WO disclosed
US-6458810-B1 TREATMENT OF DISEASE STATES MEDIATED BY, TNF.ALPHA.. A TYPICAL EMBODIMENT IS TUMOR NECROSIS FACTOR FOR CANCER TREATMENT CELGENE CORPORATION 2002-10-01 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 (3 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-20040122052-A1 Pharmaceutically active isoindoline derivatives TNF, RELA, NFKBIA DDB1 2659/4885CRBN 4232/4885TYMS 1866/4885
US-20060069126-A1 Pharmaceutically active isoindoline derivatives TNF, RELA, NFKBIA DDB1 2244/4885CRBN 4077/4885TYMS 2345/4885
US-20030069428-A1 Pharmaceutically active isoindoline derivatives TNF, RELA, NFKBIA DDB1 2659/4885CRBN 4232/4885TYMS 1866/4885

“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.