SCHEMBL3516690

SCHEMBL3516690

CCOC(=O)Cn1cc(C)c(=O)[nH]c1=O

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.68
LMNA P02545 1/20 0.54
MAPK1 P28482 1/20 0.50
TK1 P04183 5/20 0.49
HPGD P15428 1/20 0.49
GSK3A P49840 1/20 0.47
GSK3B P49841 1/20 0.47
TYMP P19971 1/20 0.47

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
SCHEMBL3519506 0.89 KMT2A (0.56) KMT2ALMNAMAPK1TK1HPGD
SCHEMBL10474752 0.86 KMT2A (0.52) KMT2AMAPK1TK1HPGDTYMP
SCHEMBL7643586 0.85 MAPK1 (0.51) KMT2AMAPK1TK1HPGDTYMP
SCHEMBL6167702 0.84 KMT2A (0.51) KMT2ALMNAMAPK1TK1HPGD
SCHEMBL28811538 0.84 TK1 (0.56) KMT2ALMNATK1TYMP
SCHEMBL28811576 0.84 TK1 (0.56) KMT2ALMNATK1TYMP
SCHEMBL23211184 0.84 KMT2A (0.64) KMT2ALMNAMAPK1GSK3AGSK3B
SCHEMBL21695505 0.84 LMNA (0.74) KMT2ALMNAMAPK1TK1HPGD
SCHEMBL4160782 0.84 KMT2A (0.64) KMT2ALMNAGSK3AGSK3B
SCHEMBL17013819 0.83 MAPK1 (0.56) MAPK1TK1HPGDTYMP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016043661-A1 MODIFIED PEPTIDE NUCLEIC ACIDS AND THEIR USE NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2016-03-24 WO disclosed
WO-2016043661-A1 MODIFIED PEPTIDE NUCLEIC ACIDS AND THEIR USE NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2016-03-24 WO disclosed
US-8501498-B2 Mass tags for quantitative analyses DH TECHNOLOGIES DEVELOPMENT PTE. LTD. (SG) 2013-08-06 US disclosed
US-20100311175-A1 MASS TAGS FOR QUANTITATIVE ANALYSES Life Technologies Corporation (US) 2010-12-09 US disclosed
CN-101443664-A Mass tags for quantitative analyses APPLERA CORP (US) 2009-05-27 CN disclosed
EP-1994413-A2 MASS TAGS FOR QUANTITATIVE ANALYSES Applera Corporation (US) 2008-11-26 EP disclosed
WO-2007100506-A2 MASS TAGS FOR QUANTITATIVE ANALYSES APPLERA CORPORATION (US) 2007-09-07 WO disclosed
EP-1776588-A1 MASS TAGS FOR QUANTITATIVE ANALYSES Applera Corporation (US) 2007-04-25 EP disclosed
US-20070048752-A1 Mass tags for quantitative analyses APPLERA CORPORATION (US) 2007-03-01 US disclosed
EP-1105525-B1 A PROCESS FOR PREPARING PEPTIDE NUCLEIC ACID PROBE USING POLYMERIC PHOTOACID GENERATOR SAMSUNG ELECTRONICS CO LTD (KR) 2006-11-02 EP disclosed
US-20060172319-A1 Mass tags for quantitative analyses APPLERA CORPORATION (US) 2006-08-03 US disclosed
WO-2006017208-A1 MASS TAGS FOR QUANTITATIVE ANALYSES APPLERA CORPORATION (US) 2006-02-16 WO disclosed
US-6660479-B2 Derivatizing surface of a solid matrix and attaching linker with acid- labile protecting group on solid matrix; coating solid matrix with polymeric photoacid generator(PAG); exposing solid matrix thus coated to light to generate acid; reacting SAMSUNG ELECTRONICS CO., LTD. (KR) 2003-12-09 US disclosed
US-6465650-B1 INTERMEDIATE STEPS IN PREPARING PEPTIDE NUCLEIC ACIDS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-10-15 US disclosed
US-20020122874-A1 Process for preparing peptide nucleic acid probe using polymeric photoacid generator SAMSUNG ELECTRONICS CO., LTD. (KR) 2002-09-05 US disclosed
US-6359125-B1 DERIVATIZING SURFACE OF SOLID MATRIX WITH AMINOALKYLOXYSILANE AND ATTACHING LINKER WITH ACID-LABILE PROTECTING GROUP TO AMINE GROUP ON MATRIX, COATING MATRIX WITH POLYMERIC PHOTOACID GENERATOR, EXPOSING TO LIGHT, ATTACHING PEPTIDE NUCLEIC ACID SAMSUNG ELECTRONICS CO., LTD. (KR) 2002-03-19 US disclosed
US-6316595-B1 PNA synthesis using a base-labile amino protecting group AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-11-13 US disclosed
US-6121418-A PNA synthesis using a base-labile amino protecting group HOECHST AKTIENGESELLSCHAFT (DE) 2000-09-19 US disclosed
US-6075143-A USEFUL FOR FORMING PEPTIDE NUCLEIC ACIDS OR HYBRID OF PEPTIDE NUCLEIC ACIDS AND DEOXYNUCLEIC ACID HOECHST AKTIENGESELLSCHAFT (DE) 2000-06-13 US 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-20100311175-A1 MASS TAGS FOR QUANTITATIVE ANALYSES SRMS, PTMS, TMT1A KMT2A 1918/4885LMNA 863/4885MAPK1 4795/4885
US-20070048752-A1 Mass tags for quantitative analyses SRMS, PTMS, TMT1A KMT2A 1918/4885LMNA 863/4885MAPK1 4795/4885
US-20060172319-A1 Mass tags for quantitative analyses SRMS, PTMS, TMT1A KMT2A 1918/4885LMNA 863/4885MAPK1 4795/4885

“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.