SCHEMBL2706925

SCHEMBL2706925

NC(=O)c1ccc(N2CCNCC2)nc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.53
UBE2T Q9NPD8 1/20 0.53
KCNH2 Q12809 1/20 0.52
OPRM1 P35372 1/20 0.51
OPRK1 P41145 1/20 0.51
HDAC2 Q92769 5/20 0.51
HDAC3 O15379 3/20 0.51
HRH3 Q9Y5N1 3/20 0.50
HPGDS O60760 1/20 0.50
HDAC1 Q13547 4/20 0.49
HDAC10 Q969S8 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
SMO Q99835 1/20 0.49
ACVR1 Q04771 1/20 0.49
JAK2 O60674 1/20 0.48
JAK1 P23458 1/20 0.48
JAK3 P52333 1/20 0.48

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
SCHEMBL29524173 1.00 PARP1 (0.53) PARP1UBE2TKCNH2OPRM1OPRK1
Hydrochloric Acid SCHEMBL29475075 0.98 PARP1 (0.52) PARP1UBE2TKCNH2OPRM1OPRK1
Trifluoroacetic Acid SCHEMBL30349640 0.91 HPGDS (0.52) PARP1UBE2TKCNH2OPRM1OPRK1
Hydrochloric Acid SCHEMBL20293527 0.87 GPR119 (0.54) KCNH2HDAC2HDAC3HDAC1HDAC10
SCHEMBL1896186 0.86 KCNH2 (0.53) UBE2TKCNH2HDAC2HDAC3HRH3
SCHEMBL30289763 0.85 UBE2T (0.71) PARP1UBE2TOPRM1OPRK1HRH3
SCHEMBL29475033 0.85 UBE2T (0.71) PARP1UBE2TOPRM1OPRK1HRH3
SCHEMBL4935859 0.84 MAPT (0.51) UBE2TKCNH2HDAC2HDAC3HRH3
SCHEMBL7547417 0.84 KCNH2 (0.52) UBE2TKCNH2HDAC2HDAC3HRH3
SCHEMBL7550033 0.84 KCNH2 (0.52) UBE2TKCNH2HDAC2HDAC3HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118344338-A Substituted 4-aminoisoindoline-1, 3-dione compounds and their use for the treatment of lymphomas 细胞基因公司 2024-07-16 CN disclosed
US-20240217955-A1 SUBSTITUTED 4-AMINOISOINDOLINE-1,3-DIONE COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH SIGNAL PHARMACEUTICALS, LLC 2024-07-04 US disclosed
CN-111989322-B Substituted 4-aminoisoindoline-1, 3-dione compounds and their use for the treatment of lymphomas 细胞基因公司 2024-04-02 CN disclosed
CN-113214220-B Substituted 4-aminoisoindoline-1, 3-dione compounds and their use for the treatment of lymphomas 细胞基因公司 2024-04-02 CN disclosed
US-11945804-B2 Substituted 4-aminoisoindoline-1,3-dione compounds, compositions thereof, and methods of treatment therewith CELGENE CORPORATION (US) 2024-04-02 US disclosed
EP-4272737-A2 SUBSTITUTED 4-AMINOISOINDOLINE-1,3-DIONE COMPOUNDS AND THEIR USE FOR TREATING LYMPHOMA Celgene Corporation (US) 2023-11-08 EP disclosed
EP-3784663-B1 SUBSTITUTED 4-AMINOISOINDOLINE-1,3-DIONE COMPOUNDS AND THEIR USE FOR TREATING LYMPHOMA CELGENE CORP (US) 2023-07-12 EP disclosed
US-20220306611-A1 SUBSTITUTED 4-AMINOISOINDOLINE-1,3-DIONE COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH SIGNAL PHARMACEUTICALS, LLC 2022-09-29 US disclosed
US-11358952-B2 Substituted 4-aminoisoindoline-1,3-dione compounds, compositions thereof, and methods of treatment therewith CELGENE CORPORATION (US) 2022-06-14 US disclosed
CN-113214220-A Substituted 4-aminoisoindoline-1, 3-dione compounds and their use for treating lymphomas 细胞基因公司 2021-08-06 CN disclosed
EP-1950199-A1 Proline derivatives and use thereof as drugs Mitsubishi Tanabe Pharma Corporation (JP) 2008-07-30 EP disclosed
EP-1930319-A1 Proline derivatives and use thereof as drugs Mitsubishi Tanabe Pharma Corporation (JP) 2008-06-11 EP disclosed
US-20060173056-A1 Proline derivatives and use thereof as drugs KITAJIMA HIROSHI 2006-08-03 US disclosed
US-7074794-B2 Proline derivatives and the use thereof as drugs MITSUBISHI PHARMA CORPORATION (JP) 2006-07-11 US disclosed
US-7060722-B2 Proline derivatives and use thereof as drugs MITSUBISHI PHARMA CORPORATION (JP) 2006-06-13 US disclosed
US-20050245538-A1 Proline derivatives and use thereof as drugs KITAJIMA HIROSHI 2005-11-03 US disclosed
US-20040106655-A1 Proline derivatives and the use thereof as drugs MITSUBISHI TANABE PHARMA CORPORATION (JP) 2004-06-03 US disclosed
EP-1308439-A1 PROLINE DERIVATIVES AND USE THEREOF AS DRUGS WELFIDE CORPORATION (JP) 2003-05-07 EP disclosed
EP-1289982-A1 BIOISOSTERIC BENZAMIDE DERIVATIVES AND THEIR USE AS APOB-100 SECRETION INHIBITORS GLAXO GROUP LIMITED (GB) 2003-03-12 EP disclosed
WO-2001096327-A1 BIOISOSTERIC BENZAMIDE DERIVATIVES AND THEIR USE AS APoB-100 SECRETION INHIBITORS GLAXO GROUP LIMITED (GB) 2001-12-20 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 (7 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-11945804-B2 Substituted 4-aminoisoindoline-1,3-dione compounds, compositions thereof, and methods of treatment therewith AANAT, HTR2C, AADAT PARP1 737/4885UBE2T 1247/4885KCNH2 1430/4885
US-20060173056-A1 Proline derivatives and use thereof as drugs DPP4, DPP3, DPP7 PARP1 2243/4885UBE2T 2512/4885KCNH2 3903/4885
US-20240217955-A1 SUBSTITUTED 4-AMINOISOINDOLINE-1,3-DIONE COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH AANAT, HTR2C, AADAT PARP1 737/4885UBE2T 1247/4885KCNH2 1430/4885
US-20050245538-A1 Proline derivatives and use thereof as drugs DPP4, DPP3, DPP7 PARP1 2243/4885UBE2T 2512/4885KCNH2 3903/4885
US-20040106655-A1 Proline derivatives and the use thereof as drugs DPP4, DPP3, DPP7 PARP1 1968/4885UBE2T 3237/4885KCNH2 4016/4885
US-11358952-B2 Substituted 4-aminoisoindoline-1,3-dione compounds, compositions thereof, and methods of treatment therewith AANAT, HTR2C, AADAT PARP1 737/4885UBE2T 1247/4885KCNH2 1430/4885
US-20220306611-A1 SUBSTITUTED 4-AMINOISOINDOLINE-1,3-DIONE COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH AANAT, HTR2C, AADAT PARP1 737/4885UBE2T 1247/4885KCNH2 1430/4885

“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.