SCHEMBL20168494

SCHEMBL20168494

CCOC(=O)c1cn(COCC[Si](C)(C)C)c(Br)n1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 5/20 0.46
GAA P10253 1/20 0.40
GABRA2 P47869 7/20 0.39
GABRB2 P47870 7/20 0.39
CYP1A2 P05177 1/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
POLB P06746 1/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL2553654 0.87 DGAT1 (0.41) DGAT1GAAGABRA2GABRB2CYP1A2
SCHEMBL7431910 0.87 DGAT1 (0.49) DGAT1GAAGABRA2GABRB2CYP1A2
SCHEMBL13734146 0.84 DGAT1 (0.40) DGAT1
SCHEMBL15701589 0.84 DGAT1 (0.40) DGAT1
SCHEMBL20177079 0.84 GABRA2 (0.41) GAAGABRA2GABRB2CYP1A2KDM4E
SCHEMBL21266229 0.84 GAA (0.39) GAAGABRA2GABRB2CYP1A2KDM4E
SCHEMBL27094252 0.84 DGAT1 (0.45) DGAT1GAAGABRA2GABRB2CYP1A2
SCHEMBL13733546 0.84 DGAT1 (0.61) DGAT1ALDH1A1HPGDSMN1; SMN2
SCHEMBL21645879 0.83 DGAT1 (0.40) DGAT1
SCHEMBL24736389 0.83 DGAT1 (0.44) DGAT1GAAGABRA2GABRB2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3829559-B1 INHIBITORS OF HISTONE DEACETYLASE USEFUL FOR THE TREATMENT OR PREVENTION OF HIV INFECTION MERCK SHARP & DOHME LLC (US) 2026-05-13 EP disclosed
US-12583838-B2 Analogs for the treatment of disease Insilico Medicine Hong Kong Limited (CN) 2026-03-24 US disclosed
US-12552778-B2 2026-02-17 US disclosed
EP-3941457-B1 INHIBITORS OF HISTONE DEACETYLASE USEFUL FOR THE TREATMENT OR PREVENTION OF HIV INFECTION MERCK SHARP & DOHME LLC (US) 2026-01-21 EP disclosed
EP-4323354-B1 2-((4-((S)-2-(4-CHLORO-2-FLUOROPHENYL)-2-METHYLBENZO[D][1,3]DIOXOL-4-YL)PIPERIDIN-1-YL)METHYL)-1-(((S)-OXETAN-2-YL)METHYL)-1H-IMIDAZOLE DERIVATIVES AS ACTIVATORS OF THE GLP1 RECEPTOR FOR THE TREATMENT OF OBESITY NOVARTIS AG (CH) 2025-12-17 EP disclosed
EP-4577524-A1 METHODS OF MANUFACTURING KINASE INHIBITORS Insilico Medicine IP Limited (HK) 2025-07-02 EP disclosed
US-12331044-B2 Inhibitors of histone deacetylase useful for the treatment or prevention of HIV infection MERCK SHARP & DOHME LLC (US) 2025-06-17 US disclosed
CN-119923387-A Method for producing kinase inhibitors 英矽智能科技知识产权有限公司 2025-05-02 CN disclosed
EP-4543874-A1 HERBICIDAL IMIDAZOLE-CONTAINING COMPOUNDS Syngenta Crop Protection AG (CH) 2025-04-30 EP disclosed
US-11976069-B2 Inhibitors of histone deacetylase useful for the treatment or prevention of HIV infection MERCK SHARP & DOHME LLC (US) 2024-05-07 US disclosed
EP-3941457-A1 INHIBITORS OF HISTONE DEACETYLASE USEFUL FOR THE TREATMENT OR PREVENTION OF HIV INFECTION Merck Sharp & Dohme Corp. (US) 2022-01-26 EP disclosed
EP-3535258-B1 SUBSTITUTED BICYCLE HETEROCYCLIC DERIVATIVES USEFUL AS ROMK CHANNEL INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2021-11-24 EP disclosed
US-20210276992-A1 INHIBITORS OF HISTONE DEACETYLASE USEFUL FOR THE TREATMENT OR PREVENTION OF HIV INFECTION MERCK SHARP & DOHME CORP. (US) 2021-09-09 US disclosed
EP-3829559-A1 INHIBITORS OF HISTONE DEACETYLASE USEFUL FOR THE TREATMENT OR PREVENTION OF HIV INFECTION Merck Sharp & Dohme Corp. (US) 2021-06-09 EP disclosed
WO-2020190827-A1 INHIBITORS OF HISTONE DEACETYLASE USEFUL FOR THE TREATMENT OR PREVENTION OF HIV INFECTION MERCK SHARP & DOHME CORP. (US) 2020-09-24 WO disclosed
US-10723723-B2 Substituted bicycle heterocyclic derivatives useful as ROMK channel inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2020-07-28 US disclosed
WO-2020028150-A1 INHIBITORS OF HISTONE DEACETYLASE USEFUL FOR THE TREATMENT OR PREVENTION OF HIV INFECTION MERCK SHARP & DOHME CORP. (US) 2020-02-06 WO disclosed
EP-3535258-A1 SUBSTITUTED BICYCLE HETEROCYCLIC DERIVATIVES USEFUL AS ROMK CHANNEL INHIBITORS Bristol-Myers Squibb Company (US) 2019-09-11 EP disclosed
US-20190248769-A1 SUBSTITUTED BICYCLE HETEROCYCLIC DERIVATIVES USEFUL AS ROMK CHANNEL INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2019-08-15 US disclosed
WO-2018093569-A1 SUBSTITUTED BICYCLE HETEROCYCLIC DERIVATIVES USEFUL AS ROMK CHANNEL INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-05-24 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-10723723-B2 Substituted bicycle heterocyclic derivatives useful as ROMK channel inhibitors KCNB1, CACNA1E, GRK1 DGAT1 1958/4885GAA 4732/4885GABRA2 1026/4885
US-20190248769-A1 SUBSTITUTED BICYCLE HETEROCYCLIC DERIVATIVES USEFUL AS ROMK CHANNEL INHIBITORS KCNB1, CACNA1E, GRK1 DGAT1 1958/4885GAA 4732/4885GABRA2 1026/4885
US-12331044-B2 Inhibitors of histone deacetylase useful for the treatment or prevention of HIV infection HDAC1, HDAC11, HDAC10 DGAT1 4019/4885GAA 410/4885GABRA2 4335/4885
US-11976069-B2 Inhibitors of histone deacetylase useful for the treatment or prevention of HIV infection HDAC1, HDAC11, HDAC2 DGAT1 3788/4885GAA 237/4885GABRA2 4257/4885
US-20210276992-A1 INHIBITORS OF HISTONE DEACETYLASE USEFUL FOR THE TREATMENT OR PREVENTION OF HIV INFECTION HDAC1, HDAC11, HDAC10 DGAT1 4019/4885GAA 410/4885GABRA2 4335/4885
US-12552778-B2 MAP4K2, MAP4K4, MAP4K1 DGAT1 2963/4885GAA 2628/4885GABRA2 3924/4885
US-12583838-B2 Analogs for the treatment of disease MAP4K4, MAP4K2, MAP4K5 DGAT1 2935/4885GAA 2007/4885GABRA2 3884/4885

“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.