SCHEMBL4766950

SCHEMBL4766950

CC(C)(C)OC(=O)N1CCC(c2cncc(N)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.51
MAPT P10636 1/20 0.51
THRB P10828 1/20 0.51
DDB1 Q16531 1/20 0.49
CRBN Q96SW2 1/20 0.49
GPR119 Q8TDV5 8/20 0.48
NAMPT P43490 1/20 0.47
HPGD P15428 2/20 0.45
DPP4 P27487 1/20 0.45
WNT3A P56704 1/20 0.44
HTT P42858 1/20 0.44
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HSD17B10 Q99714 1/20 0.43
RECQL P46063 1/20 0.43

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
SCHEMBL29760214 0.93 PDE4B (0.51) KDM4EMAPTTHRBDDB1CRBN
SCHEMBL16269235 0.93 PDE4B (0.51) KDM4EMAPTTHRBDDB1CRBN
SCHEMBL21966679 0.86 KDM4E (0.52) KDM4EMAPTTHRBDDB1CRBN
SCHEMBL20744266 0.85 MAPT (0.51) KDM4EMAPTTHRBDDB1CRBN
SCHEMBL16271572 0.85 KDM4E (0.51) KDM4EMAPTTHRBDDB1CRBN
SCHEMBL15939963 0.84 DDB1 (0.58) KDM4EMAPTTHRBDDB1CRBN
SCHEMBL21381666 0.84 HTT (0.53) KDM4EMAPTTHRBDDB1CRBN
SCHEMBL15984969 0.84 DDB1 (0.51) KDM4EMAPTTHRBDDB1CRBN
SCHEMBL30149836 0.84 HTT (0.53) KDM4EMAPTTHRBDDB1CRBN
SCHEMBL23211935 0.83 THRB (0.49) KDM4EMAPTTHRBDDB1CRBN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4619406-A1 TRICYCLIC COMPOUNDS Schrödinger, Inc. (US) 2025-09-24 EP disclosed
US-20240307385-A1 NOVEL COMPOUNDS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2024-09-19 US disclosed
WO-2024107393-A1 TRICYCLIC COMPOUNDS SCHRÖDINGER, INC. (US) 2024-05-23 WO disclosed
US-11969423-B2 Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2024-04-30 US disclosed
CN-111225910-B Novel compounds 葛兰素史密斯克莱知识产权发展有限公司 2023-03-24 CN disclosed
EP-3719019-B1 NEW 3,4-DIHYDRO-2H-ISOQUINOLINE-1-ONE AND 2,3-DIHYDRO-ISOINDOL-1-ONE COMPOUNDS HOFFMANN LA ROCHE (CH) 2022-01-19 EP disclosed
EP-3719019-B1 NEW 3,4-DIHYDRO-2H-ISOQUINOLINE-1-ONE AND 2,3-DIHYDRO-ISOINDOL-1-ONE COMPOUNDS HOFFMANN LA ROCHE (CH) 2022-01-19 EP disclosed
EP-3668853-B1 NOVEL COMPOUNDS GLAXOSMITHKLINE IP DEV LTD (GB) 2021-09-29 EP disclosed
EP-3668853-B1 NOVEL COMPOUNDS GLAXOSMITHKLINE IP DEV LTD (GB) 2021-09-29 EP disclosed
EP-3719019-A1 NEW 3,4-DIHYDRO-2H-ISOQUINOLINE-1-ONE AND 2,3-DIHYDRO-ISOINDOL-1-ONE COMPOUNDS F. Hoffmann-La Roche AG (CH) 2020-10-07 EP disclosed
WO-2014191336-A1 NEW 3,4-DIHYDRO-2H-ISOQUINOLINE-1-ONE AND 2,3-DIHYDRO-ISOINDOL-1-ONE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2014-12-04 WO disclosed
WO-2014191336-A1 NEW 3,4-DIHYDRO-2H-ISOQUINOLINE-1-ONE AND 2,3-DIHYDRO-ISOINDOL-1-ONE COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2014-12-04 WO disclosed
EP-1590326-A4 SUBSTITUTED ALKYL AMIDO PIPERIDINES LUNDBECK & CO AS H (DK) 2008-04-30 EP disclosed
US-7199135-B2 Substituted alkyl amido piperidines H. LUNDBECK A/S (DK) 2007-04-03 US disclosed
US-7199135-B2 Substituted alkyl amido piperidines H. LUNDBECK A/S (DK) 2007-04-03 US disclosed
US-20060217418-A1 Substituted alkyl amido piperidines H. LUNDBECK A/S (DK) 2006-09-28 US disclosed
US-20060084649-A9 Substituted alkyl amido piperidines SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2006-04-20 US disclosed
EP-1590326-A2 SUBSTITUTED ALKYL AMIDO PIPERIDINES H. Lundbeck A/S (DK) 2005-11-02 EP disclosed
US-20040186103-A1 Substituted alkyl amido piperidines SYNAPTIC PHARMACEUTICAL CORPORATION 2004-09-23 US disclosed
WO-2004064764-A2 SUBSTITUTED ALKYL AMIDO PIPERIDINES H. LUNDBECK A/S (DK) 2004-08-05 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 (5 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-20240307385-A1 NOVEL COMPOUNDS FNTB, SDHA, FDPS KDM4E 4291/4885MAPT 1598/4885THRB 1941/4885
US-20060084649-A9 Substituted alkyl amido piperidines MCHR1, MCHR2, MC1R KDM4E 1703/4885MAPT 3026/4885THRB 409/4885
US-11969423-B2 Compounds SDHA, SDHB, FDPS KDM4E 4043/4885MAPT 881/4885THRB 2160/4885
US-20060217418-A1 Substituted alkyl amido piperidines MCHR1, MCHR2, MC1R KDM4E 1703/4885MAPT 3026/4885THRB 409/4885
US-20040186103-A1 Substituted alkyl amido piperidines MCHR1, MCHR2, MC1R KDM4E 1703/4885MAPT 3026/4885THRB 409/4885

“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.