SCHEMBL416167

SCHEMBL416167

CC1(C)CC(C(=O)O)CC(C)(C)N1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.58
CYP2C19 P33261 2/20 0.50
GAA P10253 4/20 0.43
KDM4E B2RXH2 3/20 0.43
ALOX15 P16050 3/20 0.43
ALDH1A1 P00352 2/20 0.43
CYP1A2 P05177 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
SLC6A4 P31645 1/20 0.36
MAPT P10636 2/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 2/20 0.34
GRM2 Q14416 2/20 0.33
GRM3 Q14832 2/20 0.33
GRM4 Q14833 2/20 0.33
TSHR P16473 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
GRM8 O00222 1/20 0.33
GRM6 O15303 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL13979304 0.85 APLNR (0.41) APLNRCYP2C19GAAKDM4EALOX15
SCHEMBL12110903 0.81 APLNR (0.58) APLNRCYP2C19KDM4EALOX15ALDH1A1
SCHEMBL676895 0.81 APLNR (0.58) APLNRCYP2C19KDM4EALOX15ALDH1A1
SCHEMBL3004068 0.81 GAA (0.43) APLNRGAAKDM4EALOX15ALDH1A1
SCHEMBL224980 0.81 APLNR (0.58) APLNRCYP2C19KDM4EALOX15ALDH1A1
SCHEMBL3741329 0.79 GAA (0.41) APLNRGAAKDM4EALOX15ALDH1A1
SCHEMBL20711669 0.79 GAA (0.41) APLNRGAAKDM4EALOX15ALDH1A1
SCHEMBL15951391 0.79 APLNR (0.56) APLNRCYP2C19KDM4EALOX15ALDH1A1
SCHEMBL9063731 0.79 GAA (0.38) APLNRGAAKDM4EALOX15ALDH1A1
SCHEMBL16175990 0.77 APLNR (0.43) APLNRCYP2C19GAAKDM4EALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4714957-A1 (METH)ACRYLATE COMPOUND PRODUCTION METHOD MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2026-03-25 EP claimed
US-20260008751-A1 NITROXYL POLYPHENOL DERIVATIVE, METHODS FOR THE PREPARATION THEREOF AND USE THEREOF UNIWERSYTET WARSZAWSKI (PL) 2026-01-08 US claimed
WO-2025019426-A1 ELECTROCHEMICAL CO2 CAPTURE WITH AIR STABLE REDOX SPECIES PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2025-01-23 WO claimed
WO-2024237180-A1 (METH)ACRYLATE COMPOUND PRODUCTION METHOD 三菱瓦斯化学株式会社 2024-11-21 WO claimed
US-12110271-B2 Manufacturing method for 4-methoxypyrrole derivatives DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2024-10-08 US claimed
WO-2024010473-A1 NITROXYL POLYPHENOL DERIVATIVE, METHODS FOR THE PREPARATION THEREOF AND USE THEREOF UNIWERSYTET WARSZAWSKI (PL) 2024-01-11 WO claimed
WO-2023229323-A1 METHOD FOR PREPARING 6-METHOXYPYRIDIN-3-YL DERIVATIVE 일동제약(주) 2023-11-30 WO claimed
CN-115710701-A Chemical gold plating solution and application 广东东硕科技有限公司 2023-02-24 CN claimed
WO-2022264971-A1 METHOD FOR EVALUATING QUALITY OF SPERM 国立大学法人東海国立大学機構 2022-12-22 WO claimed
CN-113185724-B All-rubber-powder elastomer material capable of being repeatedly processed and preparation method thereof 华南理工大学 2022-12-16 CN claimed
US-6740528-B2 MONITORING REACTIVE IONS IN SAMPLE; OBTAIN SAMPLE, INCUBATE WITH MODULATOR OF IONIC ACTIVITY, ANALYZE WITH ELECTRON SPIN RESONANCE, COUNT REACTIVE IONS HAKUTO CO., LTD. (JP) 2004-05-25 US claimed
US-6696533-B1 MOLECULAR WEIGHT CONTROL; MONODISPERSITY BASF AKTIENGESELLSCHAFT (DE) 2004-02-24 US claimed
US-20040010159-A1 Blends of quinone alkide and nitroxyl compounds and polymerization inhibitors ADDIVANT USA, LLC 2004-01-15 US claimed
EP-1017728-B1 METHOD FOR PRODUCING PARTICULATE POLYMERS BY ADDITIONALLY USING A STABLE N-OXYL RADICAL BASF AG (DE) 2003-02-26 EP claimed
US-6503983-B1 Stable N-oxyl radial assisted mini emulsion polymerization BASF AKTIENGESELLSCHAFT (DE) 2003-01-07 US claimed
US-20020123658-A1 Recycle of nitroxyl-containing streams at low temperature CROMPTON CORPORATION 2002-09-05 US claimed
EP-1235885-A1 COMPOSITION AND METHOD FOR INHIBITING POLYMERIZATION AND POLYMER GROWTH Uniroyal Chemical Company, Inc. (US) 2002-09-04 EP claimed
EP-0991672-B1 METHOD FOR AQUEOUS EMULSION POLYMERIZATION INITIATED BY FREE-RADICALS FOR PRODUCING AN AQUEOUS POLYMER DISPERSION BASF AG (DE) 2002-08-21 EP claimed
US-20020048820-A1 Method for measuring concentration of stable free radical compound HAKUTO CO., LTD. 2002-04-25 US claimed
WO-2001040404-A1 COMPOSITION AND METHOD FOR INHIBITING POLYMERIZATION AND POLYMER GROWTH UNIROYAL CHEMICAL COMPANY, INC. (US) 2001-06-07 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 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-20260008751-A1 NITROXYL POLYPHENOL DERIVATIVE, METHODS FOR THE PREPARATION THEREOF AND USE THEREOF NFE2L2, NQO1, NOS3 APLNR 3586/4885CYP2C19 974/4885GAA 2032/4885
US-12110271-B2 Manufacturing method for 4-methoxypyrrole derivatives COMT, TH, HPD APLNR 4804/4885CYP2C19 53/4885GAA 1321/4885
US-20020123658-A1 Recycle of nitroxyl-containing streams at low temperature NQO2, NOS2, NOS1 APLNR 4481/4885CYP2C19 784/4885GAA 2720/4885
US-20040010159-A1 Blends of quinone alkide and nitroxyl compounds and polymerization inhibitors SQOR, NQO1, NQO2 APLNR 3664/4885CYP2C19 789/4885GAA 2247/4885

“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.