SCHEMBL5765341

SCHEMBL5765341

CC(C)(C)OC(=O)N1CCn2cncc2C1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 3/20 0.49
POLB P06746 1/20 0.45
GPR119 Q8TDV5 5/20 0.43
HTT P42858 1/20 0.42
ATM Q13315 1/20 0.42
NAMPT P43490 2/20 0.42
ESR2 Q92731 1/20 0.42
MAPT P10636 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.41
CDK1 P06493 1/20 0.41
MYT1 Q01538 1/20 0.41

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
SCHEMBL18702115 0.81 NAMPT (0.44) NAMPTCDK1MYT1
SCHEMBL25937813 0.80 SIGMAR1 (0.47) NR1H2NAMPTALDH1A1CDK1MYT1
SCHEMBL18711411 0.79 NAMPT (0.47) ATMNAMPTCDK1MYT1
SCHEMBL29192669 0.77 NAMPT (0.48) POLBNAMPTCDK1MYT1
SCHEMBL2752666 0.75 NR1H2 (0.53) NR1H2POLBGPR119NAMPTESR2
SCHEMBL29215763 0.75 NAMPT (0.47) POLBHTTNAMPTALDH1A1CDK1
SCHEMBL30878026 0.75 NAMPT (0.50) POLBNAMPTCDK1MYT1
SCHEMBL25629845 0.75 NAMPT (0.44) NAMPTCDK1MYT1
SCHEMBL12307403 0.74 NR1H2 (0.52) NR1H2POLBGPR119ESR2MAPT
SCHEMBL17926309 0.74 NR1H2 (0.49) NR1H2POLBGPR119HTTATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025101780-A1 PHARMACOLOGICAL CORRECTORS OF RHODOPSIN AND USES THEREOF OCTANT, INC. (US) 2025-05-15 WO disclosed
WO-2025051129-A1 ARYL HETEROCYCLIC SLC7A11 INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海深势唯思科技有限责任公司 2025-03-13 WO disclosed
WO-2025049746-A1 COMPOSITIONS COMPRISING WERNER SYNDROME HELICASE INHIBITORS AND METHODS OF USING THE SAME EIKON THERAPEUTICS, INC. (US) 2025-03-06 WO disclosed
CN-119552124-A Aryl heterocycle SLC7A11 inhibitor and preparation method and application thereof 上海深势唯思科技有限责任公司 2025-03-04 CN disclosed
US-20240343742-A1 VINYL IMIDAZOLE COMPOUNDS AS INHIBITORS OF KRAS INCYTE CORP (US) 2024-10-17 US disclosed
US-11999752-B2 Vinyl imidazole compounds as inhibitors of KRAS INCYTE CORPORATION (US) 2024-06-04 US disclosed
EP-4349828-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Shanghai Yingli Pharmaceutical Co. Ltd. (CN) 2024-04-10 EP disclosed
CN-117586265-A Nitrogen-containing heterocyclic compound, preparation method thereof and application thereof in medicine 江苏恒瑞医药股份有限公司 2024-02-23 CN disclosed
US-20230391785-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND, METHOD FOR PREPARING SAME AND USE OF SAME 280 BIO, INC. (US) 2023-12-07 US disclosed
WO-2022247770-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 上海璎黎药业有限公司 2022-12-01 WO disclosed
US-9890167-B2 Pyrazine compounds for the treatment of infectious diseases HOFFMANN-LA ROCHE INC. (US) 2018-02-13 US disclosed
EP-3245206-A1 PYRAZINE COMPOUNDS FOR THE TREATMENT OF INFECTIOUS DISEASES F. Hoffmann-La Roche AG (CH) 2017-11-22 EP disclosed
US-20160237090-A1 NOVEL PYRAZINE COMPOUNDS FOR THE TREATMENT OF INFECTIOUS DISEASES HOFFMANN-LA ROCHE INC. (US) 2016-08-18 US disclosed
WO-2016113273-A1 PYRAZINE COMPOUNDS FOR THE TREATMENT OF INFECTIOUS DISEASES F. HOFFMANN-LA ROCHE AG (CH) 2016-07-21 WO disclosed
WO-2016113273-A1 PYRAZINE COMPOUNDS FOR THE TREATMENT OF INFECTIOUS DISEASES F. HOFFMANN-LA ROCHE AG (CH) 2016-07-21 WO disclosed
EP-1286967-B1 CYCLOHEXANE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS MERCK SHARP & DOHME (GB) 2006-09-27 EP disclosed
US-7105507-B2 Cyclohexane derivatives and their use as therapeutic agents MERCK SHARP & DOHME LIMITED (GB) 2006-09-12 US disclosed
US-20030236250-A1 Cyclohexane derivatives and their use as therapeutic agents MERCK SHARP & DOHME LTD. (GB) 2003-12-25 US disclosed
EP-1286967-A1 CYCLOHEXANE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS MERCK SHARP & DOHME LTD. (GB) 2003-03-05 EP disclosed
WO-2001087838-A1 CYCLOHEXANE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS MERCK SHARP & DOHME LIMITED (GB) 2001-11-22 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-20030236250-A1 Cyclohexane derivatives and their use as therapeutic agents CNR2, CNR1, HTR1A NR1H2 284/4885POLB 2365/4885GPR119 923/4885
US-20230391785-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND, METHOD FOR PREPARING SAME AND USE OF SAME NRAS, KRAS, REN NR1H2 1968/4885POLB 3821/4885GPR119 2104/4885
US-20240343742-A1 VINYL IMIDAZOLE COMPOUNDS AS INHIBITORS OF KRAS KRAS, NRAS, HRAS NR1H2 2650/4885POLB 813/4885GPR119 2296/4885
US-20160237090-A1 NOVEL PYRAZINE COMPOUNDS FOR THE TREATMENT OF INFECTIOUS DISEASES HAVCR2, NR1H4, ZC3HAV1 NR1H2 42/4885POLB 1770/4885GPR119 269/4885
US-11999752-B2 Vinyl imidazole compounds as inhibitors of KRAS KRAS, NRAS, HRAS NR1H2 2650/4885POLB 813/4885GPR119 2296/4885

“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.