SCHEMBL22117752

SCHEMBL22117752

CC(C)c1cc(N)ccc1OCCC1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.49
GPR119 Q8TDV5 10/20 0.47
NPC1 O15118 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CHEK2 O96017 1/20 0.45
CSF1R P07333 1/20 0.44
KDR P35968 1/20 0.44
NR1H2 P55055 1/20 0.43
KDM4E B2RXH2 1/20 0.43
PKM P14618 1/20 0.43
FAAH O00519 1/20 0.42

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
SCHEMBL22117704 0.87 TEAD1 (0.41) SCN9AGPR119L3MBTL1
SCHEMBL1027711 0.85 SCN9A (0.51) SCN9AGPR119CHEK2CSF1RKDR
SCHEMBL15244042 0.85 SCN9A (0.51) SCN9AGPR119ALDH1A1CHEK2CSF1R
SCHEMBL22117684 0.84 SCN9A (0.52) SCN9AGPR119CHEK2CSF1RKDR
SCHEMBL5970840 0.83 PDE4D (0.52) GPR119NPC1ALDH1A1MAPTMAPK1
SCHEMBL22117699 0.81 SCN9A (0.46) SCN9AGPR119NPC1ALDH1A1MAPT
SCHEMBL1669652 0.80 GPR119 (0.55) SCN9AGPR119FAAH
SCHEMBL21280426 0.80 PDE4B (0.46) SCN9AGPR119ALDH1A1NR1H2
SCHEMBL23453749 0.76 GPR119 (0.60) GPR119ALDH1A1CHEK2
SCHEMBL3505728 0.76 MGLL (0.48) GPR119NPC1ALDH1A1MAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113473987-B Substituted 3- ((3-aminophenyl) amino) piperidine-2, 6-dione compounds, compositions thereof, and methods of treatment using the same 细胞基因公司 2024-09-03 CN disclosed
US-11325889-B2 Substituted 3-((3-aminophenyl)amino)piperidine-2,6-dione compounds, compositions thereof, and methods of treatment therewith CELGENE CORPORATION (US) 2022-05-10 US disclosed
EP-3897635-A1 SUBSTITUTED 3-((3-AMINOPHENYL)AMINO)PIPERIDINE-2,6-DIONE COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH Celgene Corporation (US) 2021-10-27 EP disclosed
CN-113473987-A Substituted 3- ((3-aminophenyl) amino) piperidine-2, 6-dione compounds, compositions thereof, and methods of treatment using the same 细胞基因公司 2021-10-01 CN disclosed
WO-2020132016-A1 SUBSTITUTED 3-((3-AMINOPHENYL)AMINO)PIPERIDINE-2,6-DIONE COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH CELGENE CORPORATION (US) 2020-06-25 WO disclosed
US-20200199074-A1 SUBSTITUTED 3-((3-AMINOPHENYL)AMINO)PIPERIDINE-2,6-DIONE COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH CELGENE CORPORATION 2020-06-25 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 (2 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-11325889-B2 Substituted 3-((3-aminophenyl)amino)piperidine-2,6-dione compounds, compositions thereof, and methods of treatment therewith AR, NR5A2, ESRRA SCN9A 4018/4885GPR119 435/4885NPC1 1388/4885
US-20200199074-A1 SUBSTITUTED 3-((3-AMINOPHENYL)AMINO)PIPERIDINE-2,6-DIONE COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH AR, NR5A2, ESRRA SCN9A 4018/4885GPR119 435/4885NPC1 1388/4885

“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.