SCHEMBL40476

SCHEMBL40476

CC(C)(C)[Si](C)(C)n1ccnc1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 1/20 0.39
QPCT Q16769 1/20 0.39
HSD17B10 Q99714 1/20 0.39
QPCTL Q9NXS2 1/20 0.39
TBXAS1 P24557 2/20 0.32
CYP17A1 P05093 1/20 0.30
CYP19A1 P11511 1/20 0.30

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
Hydrochloric Acid SCHEMBL23787514 0.98 NFKB1 (0.37) NFKB1QPCTHSD17B10QPCTLTBXAS1
SCHEMBL17128637 0.77 NFKB1 (0.36) NFKB1QPCTHSD17B10QPCTL
SCHEMBL217284 0.74
SCHEMBL10503985 0.74 NFKB1 (0.46) NFKB1QPCTHSD17B10QPCTLTBXAS1
Bromide SCHEMBL28508208 0.72 NFKB1 (0.43) NFKB1QPCTHSD17B10QPCTLTBXAS1
SCHEMBL887474 0.69
SCHEMBL12020402 0.68 NFKB1 (0.43) NFKB1QPCTHSD17B10QPCTLTBXAS1
SCHEMBL918948 0.67 NFKB1 (0.39) NFKB1QPCTHSD17B10QPCTLCYP17A1
SCHEMBL21461069 0.67 NFKB1 (0.39) NFKB1QPCTHSD17B10QPCTLTBXAS1
SCHEMBL918580 0.67 NFKB1 (0.39) NFKB1QPCTHSD17B10QPCTLTBXAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025104679-A1 PROCESSES FOR MAKING INTERMEDIATES FOR ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION HAVING ANTICANCER ACTIVITY OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2025-05-22 WO claimed
US-12194448-B2 Catalysts for the transformation of carbon dioxide and glycerol to formic acid and lactic acid and methods of making the same THE GEORGE WASHINGTON UNIVERSITY (US) 2025-01-14 US claimed
CN-115458809-A Electrolyte and lithium ion battery comprising same 香河昆仑新能源材料股份有限公司 2022-12-09 CN claimed
CN-113258138-B Full-inorganic salt type rechargeable magnesium battery electrolyte and preparation method thereof 重庆大学 2022-10-21 CN claimed
CN-113258138-A Full-inorganic salt type rechargeable magnesium battery electrolyte and preparation method thereof 重庆大学 2021-08-13 CN claimed
US-11085939-B2 Quantifying phosphatidylethanol from blood samples LOYOLA UNIVERSITY OF CHICAGO (US) 2021-08-10 US claimed
CN-111900477-A High-voltage lithium ion battery electrolyte film-forming additive, electrolyte and battery thereof 松山湖材料实验室 2020-11-06 CN claimed
US-20200171474-A1 CATALYSTS FOR THE TRANSFORMATION OF CARBON DIOXIDE AND GLYCEROL TO FORMIC ACID AND LACTIC ACID AND METHODS OF MAKING THE SAME THE GEORGE WASHINGTON UNIVERSITY 2020-06-04 US claimed
CN-111100054-A α' -dihydroxy-diisopropylbenzene, bis- (tert-butylperoxyisopropyl) benzene and epoxy compound synthesis method 中国石油化工股份有限公司 2020-05-05 CN claimed
US-20190293668-A1 QUANTIFYING PHOSPHATIDYLETHANOL FROM BLOOD SAMPLES LOYOLA UNIVERSITY OF CHICAGO 2019-09-26 US claimed
US-20030125593-A1 Catalyst composition and processes therefor and therewith PHILLIPS PETROLEUM COMPANY 2003-07-03 US claimed
US-6509289-B1 Comprises an alumina, a metal oxide, a phosphorus oxide and optionally, an acid site modifier PHILLIPS PETROLEUM COMPANY 2003-01-21 US claimed
WO-2002048113-A1 CYCLIZATION PROCESS STEP IN THE MAKING OF QUINOLONES AND NAPHTHYRIDINES THE PROCTER & GAMBLE COMPANY (US) 2002-06-20 WO claimed
US-6365643-B1 Photoinitiators for cationic curing TH. GOLDSCHMIDT AG (DE) 2002-04-02 US claimed
US-20020016258-A1 CATALYST COMPOSITION AND PROCESSES THEREFOR AND THEREWITH PHILLIPS PETROLEUM COMPANY (OK) 2002-02-07 US claimed
US-6051519-A MODIFIED ZEOLITE ZSM-5 PHILLIPS PETROLEUM COMPANY (US) 2000-04-18 US claimed
US-6037302-A USING CATALYST COMPRISING ALUMINA, METAL OXIDE, PHOSPHORUS OXIDE AND OPTIONALLY, AN ACID SITE MODIFIER SELECTED FROM THE GROUP CONSISTING OF SILICON OXIDES, SULFUR OXIDES, BORON OXIDES, MAGNESIUM OXIDES, TIN OXIDES, TITANIUM OXIDES, PHILLIPS PETROLEUM COMPANY (US) 2000-03-14 US claimed
US-5877379-A CALCINED ZEOLITE/BINDER IMPREGNATED WITH SILICON OXIDES OR PHOSPHORUS OXIDES PHILLIPS PETROLEUM COMPANY (US) 1999-03-02 US claimed
US-5763721-A CATALYST COMPRISED OF METAL OXIDE PROMOTED ALUMINA CONTAINING A SILICON OXIDE AND PHOSPHORUS OXIDE PHILLIPS PETROLEUM COMPANY (US) 1998-06-09 US claimed
US-5714660-A HYDRODEALKYLATION OF AROMATIC HYDROCARBONS TO AROMATICS HAVING 6-8 CARBONS USING METAL OXIDE/ALUMINA SUPPORTED CATALYSTS IMPREGNATED WITH SILICA OR PHOSPHORUS OXIDE; ANTIDEPOSIT AGENTS, BY-PRODUCT INHIBITION PHILLIPS PETROLEUM COMPANY (US) 1998-02-03 US 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 (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-12194448-B2 Catalysts for the transformation of carbon dioxide and glycerol to formic acid and lactic acid and methods of making the same MLX, LDHA, CA2 NFKB1 4761/4885QPCT 1318/4885HSD17B10 299/4885
US-20200171474-A1 CATALYSTS FOR THE TRANSFORMATION OF CARBON DIOXIDE AND GLYCEROL TO FORMIC ACID AND LACTIC ACID AND METHODS OF MAKING THE SAME MLX, LDHA, CA2 NFKB1 4761/4885QPCT 1318/4885HSD17B10 299/4885

“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.