SCHEMBL1399082

SCHEMBL1399082

CCC1(N)CCC(=O)N(C(=O)OCc2ccccc2)C1=O

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTRB1 P17538 1/20 0.43
P2RX4 Q99571 2/20 0.43
P2RX1 P51575 1/20 0.42
P2RX3 P56373 1/20 0.42
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
HTR2C P28335 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.40
GAA P10253 1/20 0.40
MAPK1 P28482 1/20 0.40
DDB1 Q16531 1/20 0.40
CRBN Q96SW2 1/20 0.40
CYP2C19 P33261 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL1399006 0.91 CTRB1 (0.42) CTRB1P2RX4P2RX1P2RX3NPC1
SCHEMBL1398957 0.85 CTRB1 (0.45) CTRB1P2RX4P2RX1P2RX3NPC1
SCHEMBL274967 0.77 P2RX4 (0.58) CTRB1P2RX4P2RX1P2RX3NPC1
SCHEMBL8526862 0.75 P2RX4 (0.55) CTRB1P2RX4P2RX1P2RX3NPC1
SCHEMBL2202906 0.73 DDB1 (0.44) CTRB1P2RX4NPC1RAB9AHTR2C
SCHEMBL2202910 0.73 DDB1 (0.44) CTRB1P2RX4NPC1RAB9AHTR2C
SCHEMBL25176242 0.72 DDB1 (0.48) CTRB1P2RX4P2RX1P2RX3NPC1
SCHEMBL28604282 0.71 CASP1 (0.42) CTRB1P2RX4P2RX1P2RX3NPC1
SCHEMBL28604283 0.71 CASP1 (0.42) CTRB1P2RX4P2RX1P2RX3NPC1
SCHEMBL31229229 0.70 DDB1 (0.49) CTRB1P2RX4P2RX1P2RX3NPC1

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 45 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0925294-B3 SUBSTITUTED 2(2,6-DIOXOPIPERIDIN-3-YL)PHTHALIMIDES AND -1-OXOISOINDOLINES AND METHOD OF REDUCING TNF-ALPHA LEVELS CELGENE CORP (US) 2018-07-04 EP disclosed
US-20160096818-A1 SUBSTITUTED 2-(2,6-DIOXOPIPERIDIN-3-YL)-PHTHALIMIDES AND -1-OXOISOINDOLINES AND METHOD OF REDUCING TNFALPHA LEVELS CELGENE CORPORATION 2016-04-07 US disclosed
EP-2859895-A1 Substituted 2-(2,6-dioxopiperidin-3-yl)-phthalimides and 1-oxoisoindolines and method of reducing TNF alpha levels CELGENE CORPORATION (US) 2015-04-15 EP disclosed
EP-2305663-B1 Substituted 2-(2,6-dioxopiperidin-3-yl)-phthalimides and 1-oxoisoindolines and method of reducing TNF alpha levels CELGENE CORP (US) 2014-12-17 EP disclosed
US-20140187584-A1 Substituted 2-(2,6-Dioxopiperidin-3-yl)-phthalimides and -1-Oxoisoindolines and Method of Reducing TNFalpha Levels CELGENE CORPORATION (US) 2014-07-03 US disclosed
US-20130030021-A1 Substituted 2-(2,6-Dioxopiperidin-3-yl)-phthalimides and 1-Oxoisoindolines and Method of Reducing TNFalpha Levels CELGENE CORPORATION (US) 2013-01-31 US disclosed
EP-1956017-B1 Substituted 2-(2,6-dioxopiperidin-3-yl)-phthalimides and method of reducing TNF alpha levels CELGENE CORP (US) 2013-01-23 EP disclosed
US-8288415-B2 Pharmaceutical compositions of 3-(4-amino-1-oxoisoindolin-2yl)-piperidine-2,6-dione CELGENE CORPORATION (US) 2012-10-16 US disclosed
US-8158653-B2 Pharmaceutical compositions of 1,3-dioxo-2-(2,6-dioxopiperidin-3-yl)-4-amino isoindoline CELGENE CORPORATION (US) 2012-04-17 US disclosed
EP-2177517-B1 Amino substituted 2-(2,6-dioxopiperidin-3-yl)-phthalimide for reducing TNF alpha levels CELGENE CORP (US) 2011-10-26 EP disclosed
US-6476052-B1 Isoindolines, method of use, and pharmaceutical compositions CELGENE CORPORATION 2002-11-05 US disclosed
US-6395754-B1 ANTIINFLAMMATORY AGENTS, CARDIOVASCULAR DISORDERS, ANTIPYRETICS CELGENE CORPORATION, ET AL. 2002-05-28 US disclosed
US-20020045643-A1 Isoindolines, method of use, and pharmaceutical compositions MULLER GEORGE W (US) 2002-04-18 US disclosed
US-6335349-B1 AGENTS THAT REDUCE LEVELS OF TUMOR NECROSIS FACTOR; ANTICARCINOGENIC AND ANTIINFLAMMATORY AGENTS; TREATMENT OF AUTOIMMUNE DISEASES CELGENE CORPORATION 2002-01-01 US disclosed
US-6316471-B1 TREATING INFLAMMATORY OR AUTOIMMUNE DISEASES CELGENE CORPORATION 2001-11-13 US disclosed
US-6281230-B1 TREATING INFLAMMATION, INFLAMMATORY DISEASE OR AUTOIMMUNE DISEASE IN A MAMMAL CELGENE CORPORATION 2001-08-28 US disclosed
EP-0984955-A1 SUBSTITUTED 2-(2,6-DIOXOPIPERIDIN-3-YL)-PHTHALIMIDES AND 1-OXOISOINDOLINES AND METHOD OF REDUCING TNF$g(a) LEVELS Gelgene Corporation (US) 2000-03-15 EP disclosed
EP-0925294-A1 SUBSTITUTED 2(2,6-DIOXOPIPERIDIN-3-YL)PHTHALIMIDES AND -1-OXOISOINDOLINES AND METHOD OF REDUCING TNF-ALPHA LEVELS CELGENE CORPORATION (US) 1999-06-30 EP disclosed
WO-1998054170-A1 SUBSTITUTED 2-(2,6-DIOXOPIPERIDIN-3-YL)-PHTHALIMIDES AND 1-OXOISOINDOLINES AND METHOD OF REDUCING TNFα LEVELS CELGENE CORPORATION (US) 1998-12-03 WO disclosed
WO-1998003502-A1 SUBSTITUTED 2(2,6-DIOXOPIPERIDIN-3-YL)PHTHALIMIDES AND -1-OXOISOINDOLINES AND METHOD OF REDUCING TNF-ALPHA LEVELS CELGENE CORPORATION (US) 1998-01-29 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-20160096818-A1 SUBSTITUTED 2-(2,6-DIOXOPIPERIDIN-3-YL)-PHTHALIMIDES AND -1-OXOISOINDOLINES AND METHOD OF REDUCING TNFALPHA LEVELS TNF, NFKBIA, TRAF2 CTRB1 3113/4885P2RX4 2950/4885P2RX1 2807/4885
US-20140187584-A1 Substituted 2-(2,6-Dioxopiperidin-3-yl)-phthalimides and -1-Oxoisoindolines and Method of Reducing TNFalpha Levels TNF, NFKBIA, TRAF2 CTRB1 3113/4885P2RX4 2950/4885P2RX1 2807/4885
US-20020045643-A1 Isoindolines, method of use, and pharmaceutical compositions TNF, OPRK1, OPRD1 CTRB1 4302/4885P2RX4 238/4885P2RX1 152/4885
US-20130030021-A1 Substituted 2-(2,6-Dioxopiperidin-3-yl)-phthalimides and 1-Oxoisoindolines and Method of Reducing TNFalpha Levels TNF, NFKBIA, TRAF2 CTRB1 3334/4885P2RX4 2747/4885P2RX1 2601/4885

“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.