SCHEMBL2306586

SCHEMBL2306586

CC(C)(C)OC(=O)C1(N)CCC(N)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.33
CHRM2 P08172 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
GRM2 Q14416 2/20 0.32
GRM3 Q14832 2/20 0.32
GRM4 Q14833 2/20 0.32
CYP1A2 P05177 1/20 0.32
ALOX15 P16050 1/20 0.32
CYP2C19 P33261 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
GRM8 O00222 1/20 0.32
GRM6 O15303 1/20 0.32
LMNA P02545 1/20 0.32
GRM5 P41594 1/20 0.32
MTOR P42345 1/20 0.32
GRM1 Q13255 1/20 0.32
PLCB1 Q9NQ66 1/20 0.32
TSHR P16473 1/20 0.32
KDM1A O60341 1/20 0.31

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
SCHEMBL2306584 1.00 MAPK1 (0.33) MAPK1CHRM2CHRM1CHRM3GRM2
SCHEMBL25240305 0.89 GRM4 (0.33) MAPK1CHRM2CHRM1CHRM3GRM2
SCHEMBL21064068 0.88 GAA (0.32) MAPK1
SCHEMBL18361345 0.86 GAA (0.31)
SCHEMBL22722858 0.86 GAA (0.31)
SCHEMBL28201308 0.85 CHRM2 (0.39) MAPK1CHRM2CHRM1CHRM3GRM2
SCHEMBL2312894 0.84 MAPK1 (0.34) MAPK1
SCHEMBL28240411 0.81 CHRM2 (0.32) CHRM2CHRM1CHRM3KDM1A
SCHEMBL25241773 0.81 MAPK1 (0.34) MAPK1CHRM2CHRM1CHRM3KDM1A
Formic Acid SCHEMBL27651219 0.81 MAPK1 (0.31) MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116768889-A Novel CDK9 kinase inhibitor and preparation method and application thereof 厦门大学 2023-09-19 CN claimed
CN-113321650-A 3-substituent-5- (substituted aryl) -7-azaindole derivative and application thereof 厦门大学 2021-08-31 CN claimed
US-12503452-B2 Antimicrobial compounds and methods CURZA GLOBAL, LLC (US) 2025-12-23 US disclosed
WO-2024044552-A1 VHH ANTIBODY DOTA CONJUGATES Abdera Therapeutics Inc. (US) 2024-02-29 WO disclosed
CN-116768889-A Novel CDK9 kinase inhibitor and preparation method and application thereof 厦门大学 2023-09-19 CN disclosed
US-20230159491-A1 Antimicrobial Compounds and Methods NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-05-25 US disclosed
CN-113493398-B Preparation method of N-Boc-trans-cyclohexanediamine 中车长春轨道客车股份有限公司 2023-04-14 CN disclosed
CN-113321650-B 3-substituent-5- (substituted aryl) -7-azaindole derivative and application thereof 厦门大学 2022-04-12 CN disclosed
CN-113924292-A Antimicrobial compounds and methods 库扎环球有限责任公司 2022-01-11 CN disclosed
CN-111646978-B N2-substituted alkoxy aromatic ring-2-aminopyrimidine derivatives and application thereof 浙江大学 2021-12-21 CN disclosed
EP-3911644-A1 ANTIMICROBIAL COMPOUNDS AND METHODS Curza Global LLC (US) 2021-11-24 EP disclosed
EP-1450811-A2 2-ARYL PYRROLOPYRIMIDINES FOR A1 AND A3 RECEPTORS Osi Pharmaceuticals, Inc. (US) 2004-09-01 EP disclosed
US-20040029837-A1 Oxazine derivatives EVOTEC AG (DE) 2004-02-12 US disclosed
EP-1347980-A1 COMPOUNDS SPECIFIC TO ADENOSINE-A1,-A2A, AND- A3-RECEPTOR AND USES THEREOF OSI Pharmaceuticals, Inc. (US) 2003-10-01 EP disclosed
WO-2003048120-A2 2-ARYL PYRROLOGPYRIMIDINES FOR A1 AND A3 RECEPTORS OSI PHARMACEUTICALS, INC. (US) 2003-06-12 WO disclosed
EP-1317511-A1 OXAZINE DERIVATIVES Evotec BioSystems AG (DE) 2003-06-11 EP disclosed
WO-2002057267-A1 COMPOUNDS SPECIFIC TO ADENOSINE A1, A2A, AND A3 RECEPTOR AND USES THEREOF OSI PHARMACEUTICALS, INC. (US) 2002-07-25 WO disclosed
EP-1213328-A1 Oxazine derivatives Evotec OAI AG (DE) 2002-06-12 EP disclosed
WO-2002020670-A1 OXAZINE DERIVATIVES EVOTEC OAI AG (DE) 2002-03-14 WO disclosed
CN-1165815-A Phenol compound and process for preparing the same TANABE SEIYAKU CO (JP) 1997-11-26 CN 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 (3 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-20230159491-A1 Antimicrobial Compounds and Methods MPO, NISCH, RPN2 MAPK1 2873/4885CHRM2 4855/4885CHRM1 4819/4885
US-20040029837-A1 Oxazine derivatives OXA1L, HELZ, IKZF2 MAPK1 4751/4885CHRM2 3548/4885CHRM1 2357/4885
US-12503452-B2 Antimicrobial compounds and methods MPO, NISCH, RPN2 MAPK1 2873/4885CHRM2 4855/4885CHRM1 4819/4885

“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.