SCHEMBL3889039

SCHEMBL3889039

CC(C)CB(CC(C)C)CC(C)C.[NaH]

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL77787 0.96 TSHR (0.33) TSHR
SCHEMBL3974598 0.92 TSHR (0.31) TSHR
SCHEMBL216049 0.77
SCHEMBL8735877 0.68 ANPEP (0.39) TSHR
SCHEMBL26392989 0.67 TSHR (0.31) TSHR
SCHEMBL25924946 0.67
SCHEMBL7143922 0.66 ANPEP (0.38) TSHR
SCHEMBL214700 0.64
SCHEMBL5462923 0.64
SCHEMBL7636247 0.64 TSHR (0.38) TSHR

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115490743-A Method for preparing beta-salon with high stereoselectivity 长沙启晟合研医药科技有限公司 2022-12-20 CN claimed
CN-110903172-A Method for stereoselectively synthesizing (E) -tri-substituted olefin 温州大学 2020-03-24 CN claimed
CN-110878001-A Process for the isomerization of (Z) -olefins to (E) -olefins 温州大学 2020-03-13 CN claimed
US-12304889-B2 Method for producing cis-(-)-flocino piperidol Sumitomo Pharma Co., Ltd. (JP) 2025-05-20 US disclosed
CN-114933624-B Artificial synthesis method of natural product (+) -digitonin 大连理工大学 2024-02-20 CN disclosed
CN-115490743-A Method for preparing beta-salon with high stereoselectivity 长沙启晟合研医药科技有限公司 2022-12-20 CN disclosed
US-20220220072-A1 METHOD FOR PRODUCING CIS-(-) FLOCINOPIPERIDOL Sumitomo Pharma Co., Ltd. (JP) 2022-07-14 US disclosed
CN-110903172-B Method for stereoselectively synthesizing (E) -tri-substituted olefin 温州大学 2021-08-24 CN disclosed
WO-2020213714-A1 METHOD FOR PRODUCING CIS-(-)-FLUOCINO PIPERIDOL 大日本住友製薬株式会社 2020-10-22 WO disclosed
CN-110903172-A Method for stereoselectively synthesizing (E) -tri-substituted olefin 温州大学 2020-03-24 CN disclosed
CN-110878001-A Process for the isomerization of (Z) -olefins to (E) -olefins 温州大学 2020-03-13 CN disclosed
US-7572303-B2 A symmetrical dialkyl carbonate, a metal, borong, silicon, or group 7 compound, a hydrogen or hydrocarbon-based fuel, an oxidizer, and a metallic cocatalyst; minimized hydrolysis; improved combustion and storage stability OCTANE INTERNATIONAL, LTD. (US) 2009-08-11 US disclosed
EP-0954558-B1 FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY ORR WILLIAM C (US) 2006-06-14 EP disclosed
US-20050044778-A1 Fuel compositions employing catalyst combustion structure OCTANE INTERNATIONAL, LTD. 2005-03-03 US disclosed
US-20040237384-A1 Fuel compositions exhibiting improved fuel stability OCTANE INTERNATIONAL, LTD. 2004-12-02 US disclosed
US-6652608-B1 Fuel compositions exhibiting improved fuel stability OCTANE INTERNATIONAL, LTD. 2003-11-25 US disclosed
EP-1051461-A2 FUEL COMPOSITIONS EMPLOYING CATALYST COMBUSTION STRUCTURE ORR, William C. (US) 2000-11-15 EP disclosed
WO-1999066009-A2 FUEL COMPOSITIONS EMPLOYING CATALYST COMBUSTION STRUCTURE ORR WILLIAM C (US) 1999-12-23 WO disclosed
EP-0954558-A1 FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY ORR, William C. (US) 1999-11-10 EP disclosed
WO-1998026028-A1 FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY ORR WILLIAM C (US) 1998-06-18 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 (2 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-20220220072-A1 METHOD FOR PRODUCING CIS-(-) FLOCINOPIPERIDOL DHFR, DHPS, TKT TSHR 90/4885
US-12304889-B2 Method for producing cis-(-)-flocino piperidol FLOT1, DHFR, TKT TSHR 123/4885

“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.