SCHEMBL3743044

SCHEMBL3743044

CC(=O)Nc1cccc2c1CN(C1(F)CC(O)C(=O)NC1=O)C2=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 3/20 0.41
DDB1 Q16531 2/20 0.41
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
GAA P10253 2/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
CASP3 P42574 1/20 0.38
MAOA P21397 1/20 0.35
AHR P35869 1/20 0.35
TIPARP Q7Z3E1 1/20 0.34
CCNE2 O96020 3/20 0.34
CCNE1 P24864 3/20 0.34
CDK2 P24941 3/20 0.34
ADRA2A P08913 1/20 0.33
CHEK1 O14757 1/20 0.33
SLC18A3 Q16572 1/20 0.33
TYR P14679 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
SCHEMBL3744187 0.88 CRBN (0.32) CRBNDDB1
SCHEMBL3745330 0.88 CRBN (0.41) CRBNDDB1ALDH1A1KDM4EGAA
SCHEMBL3755200 0.84 HTR2A (0.36) CRBNDDB1
SCHEMBL476941 0.81 CRBN (0.44) CRBNDDB1ALDH1A1KDM4E
SCHEMBL30001714 0.81 CRBN (0.44) CRBNDDB1ALDH1A1KDM4E
SCHEMBL3749207 0.81 DDB1 (0.52) CRBNDDB1ALDH1A1KDM4EGAA
SCHEMBL3738115 0.81 CRBN (0.43) CRBNDDB1HSD17B10CASP3
SCHEMBL3752341 0.75 PDK1 (0.33) CRBNDDB1TYR
SCHEMBL3738089 0.74 CRBN (0.47) CRBNDDB1ALDH1A1KDM4EGAA
SCHEMBL3803912 0.72 DDB1 (0.52) CRBNDDB1ALDH1A1KDM4EGAA

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 CRBN 4232/4885DDB1 2659/4885ALDH1A1 237/4885
US-20060069126-A1 Pharmaceutically active isoindoline derivatives TNF, RELA, NFKBIA CRBN 4077/4885DDB1 2244/4885ALDH1A1 169/4885
US-20030069428-A1 Pharmaceutically active isoindoline derivatives TNF, RELA, NFKBIA CRBN 4232/4885DDB1 2659/4885ALDH1A1 237/4885

“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.