SCHEMBL875043

SCHEMBL875043

CC(C)(C)[Si](OCc1ccccc1[C]=O)(c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMYD2 Q9NRG4 3/20 0.35
CYP3A4 P08684 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
FFAR1 O14842 1/20 0.30
BACE1 P56817 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
SCHEMBL4822404 0.77 PDCD1 (0.34) SMYD2CYP3A4HTTSMN1; SMN2BACE1
SCHEMBL9566297 0.77 IDO1 (0.33) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL4821504 0.77 SMYD2 (0.33) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL1564661 0.77 HTT (0.44) HTT
SCHEMBL875044 0.77 BACE1 (0.39) SMYD2CYP3A4HTTSMN1; SMN2BACE1
SCHEMBL27610986 0.76 IDO1 (0.51) CYP3A4HTTSMN1; SMN2
SCHEMBL3090308 0.75 SMYD2 (0.33) SMYD2FFAR1
SCHEMBL31245516 0.74 HTT (0.37) SMYD2CYP3A4HTTSMN1; SMN2BACE1
SCHEMBL10349815 0.74 HTT (0.37) SMYD2CYP3A4HTTSMN1; SMN2BACE1
SCHEMBL2473646 0.74 SMYD2 (0.34) SMYD2CYP3A4HTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6541626-B2 Protecting/blocking the exocyclic amino function of purine nucleosides without effecting hydroxyl groups of sugar moieties via forming activated ester ISIS PHARMACEUTICALS, INC. 2003-04-01 US claimed
US-20030022862-A1 Process for selective N-acylation of purine nucleosides ALLAHABAD, UNIVERSITY OF (IN) 2003-01-30 US claimed
WO-2002083702-A1 PROCESS FOR SELECTIVE N-ACYLATION OF PURINE NUCLEOSIDES ISIS PHARMACEUTICALS, INC. (US) 2002-10-24 WO claimed
EP-0648220-A1 DEUTERATED NUCLEOSIDES CHATTOPADHYAYA, Jyoti (SE) 1995-04-19 EP claimed
WO-1993025566-A1 DEUTERATED NUCLEOSIDES CHATTOPADHYAYA JYOTI (SE) 1993-12-23 WO claimed
US-11999757-B2 Synthesis of boronate ester derivatives and uses thereof MELINTA SUBSIDIARY CORP. (US) 2024-06-04 US disclosed
CN-111556872-B Synthesis of borate derivatives and uses thereof 梅琳塔治疗公司 2024-05-10 CN disclosed
CN-117986153-A Ionizable cationic lipid compound, and preparation method and application thereof 晟迪生物医药(苏州)有限公司 2024-05-07 CN disclosed
EP-4356736-A2 SYNTHESIS OF BORONATE SALTS Melinta Therapeutics, Inc. (US) 2024-04-24 EP disclosed
EP-3604316-B1 SYNTHESIS OF BORONATE SALTS MELINTA THERAPEUTICS INC (US) 2023-12-06 EP disclosed
US-11237156-B2 Method and composition for detection of peptide cyclization using protein tags Roche Sequencing Solutions, Inc. (US) 2022-02-01 US disclosed
CN-107835871-B Methods and compositions for peptide cyclization and protease treatment 豪夫迈·罗氏有限公司 2021-07-02 CN disclosed
US-20030044831-A1 Antibody for use in the generation and protection of preferential nucleotide sequences AGRIS PAUL F (US) 2003-03-06 US disclosed
US-20030022862-A1 Process for selective N-acylation of purine nucleosides ALLAHABAD, UNIVERSITY OF (IN) 2003-01-30 US disclosed
WO-2003003014-A1 METHODS AND COMPOSITIONS FOR DETERMINING THE PURITY OF AND PURIFYING CHEMICALLY SYNTHESIZED NUCLEIC ACIDS VERI-Q, INC. (US) 2003-01-09 WO disclosed
WO-2002083702-A1 PROCESS FOR SELECTIVE N-ACYLATION OF PURINE NUCLEOSIDES ISIS PHARMACEUTICALS, INC. (US) 2002-10-24 WO disclosed
EP-1242459-A1 METHODS AND COMPOSITIONS FOR DETERMINING THE PURITY OF CHEMICALLY SYNTHESIZED NUCLEIC ACIDS NORTH CAROLINA STATE UNIVERSITY (US) 2002-09-25 EP disclosed
US-20020045167-A1 Used for detecting incomplete deprotection of a synthetic oligonucleotide by immunoassay VERI-Q, INC. 2002-04-18 US disclosed
WO-2001049745-A9 METHODS AND COMPOSITIONS FOR DETERMINING THE PURITY OF CHEMICALLY SYNTHESIZED NUCLEIC ACIDS UNIV NORTH CAROLINA STATE (US) 2001-09-20 WO disclosed
WO-2001049745-A1 METHODS AND COMPOSITIONS FOR DETERMINING THE PURITY OF CHEMICALLY SYNTHESIZED NUCLEIC ACIDS NORTH CAROLINA STATE UNIVERSITY (US) 2001-07-12 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 (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-11999757-B2 Synthesis of boronate ester derivatives and uses thereof ADH5, ADH1A, ADH7 SMYD2 3309/4885CYP3A4 43/4885HTT 4861/4885
US-20030044831-A1 Antibody for use in the generation and protection of preferential nucleotide sequences CD2BP2, IGSF11, RNGTT SMYD2 2834/4885CYP3A4 4805/4885HTT 2509/4885
US-20030022862-A1 Process for selective N-acylation of purine nucleosides PNP, NUDT1, ADAR SMYD2 2009/4885CYP3A4 2872/4885HTT 2416/4885
US-11237156-B2 Method and composition for detection of peptide cyclization using protein tags CACYBP, VIP, PTMS SMYD2 3334/4885CYP3A4 4390/4885HTT 2449/4885

“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.