SCHEMBL458786

SCHEMBL458786

CC(C)(C)OC(=O)NCCN(CC(=O)O)C(=O)Cn1cnc2c(=O)[nH]c(NC(=O)OCc3ccccc3)nc21

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
TSHR P16473 1/20 0.38
KMT2A Q03164 1/20 0.38
CKS1B P61024 1/20 0.36
SKP1 P63208 1/20 0.36
SKP2 Q13309 1/20 0.36
SYK P43405 1/20 0.35
TK1 P04183 1/20 0.35
CCNE2 O96020 1/20 0.35
CCNE1 P24864 1/20 0.35
CDK2 P24941 1/20 0.35

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
SCHEMBL430139 0.89 CKS1B (0.36) MEN1KMT2ACKS1BSKP1SKP2
SCHEMBL7263683 0.88 L3MBTL1 (0.36) MEN1TSHRKMT2ACKS1BSKP1
SCHEMBL6046933 0.86 KDM4E (0.39) MEN1TSHRKMT2ACKS1BSKP1
SCHEMBL7843680 0.85 CCNE2 (0.39) CKS1BSKP1SKP2SYKCCNE2
SCHEMBL430210 0.85 CCNE2 (0.38) MEN1KMT2ACKS1BSKP1SKP2
SCHEMBL3669585 0.84 CKS1B (0.34) MEN1KMT2ACKS1BSKP1SKP2
SCHEMBL6803680 0.84 TDP1 (0.40) CKS1BSKP1SKP2SYKCCNE2
SCHEMBL459081 0.83 MAPT (0.37) MEN1KMT2ACKS1BSKP1SKP2
SCHEMBL7913306 0.83 POLB (0.38) MEN1TSHRKMT2ATK1
SCHEMBL10077228 0.82 SYK (0.36) MEN1TSHRKMT2ACKS1BSKP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230135545-A1 BIOMIMETIC G-QUARTET COMPOUNDS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2023-05-04 US disclosed
EP-4126865-A1 BIOMIMETIC G-QUARTET COMPOUNDS Centre national de la recherche scientifique (FR) 2023-02-08 EP disclosed
US-20130231480-A1 SEQUENCE SPECIFIC DOUBLE-STRANDED DNA/RNA BINDING COMPOUNDS AND USES THEREOF GENEARREST LTD (IL) 2013-09-05 US disclosed
EP-2596102-A2 SEQUENCE SPECIFIC DOUBLE-STRANDED DNA/RNA BINDING COMPOUNDS AND USES THEREOF GeneArrest Ltd (IL) 2013-05-29 EP disclosed
WO-2012011114-A2 SEQUENCE SPECIFIC DOUBLE-STRANDED DNA/RNA BINDING COMPOUNDS AND USES THEREOF GENEARREST LTD (IL) 2012-01-26 WO disclosed
US-20100284959-A1 SEQUENCE SPECIFIC DOUBLE-STRANDED DNA/RNA BINDING COMPOUNDS AND USES THEREOF GENE ARREST LTD. (IL) 2010-11-11 US disclosed
US-20040009899-A1 Reducing the level of an RNA or polypeptide expressed by a mutant allele of a gene that causes a dominant disorder in a mammal by administering a polyamide nucleic acid oligomer that is heterozygous for such a mutant allele MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2004-01-15 US disclosed
US-6548651-B1 Conjugating cationic peptides to peptide nucleic acids; microbiocides PANTHECO A/S (DK) 2003-04-15 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-20100284959-A1 SEQUENCE SPECIFIC DOUBLE-STRANDED DNA/RNA BINDING COMPOUNDS AND USES THEREOF POLRMT, POLM, SNRPE MEN1 4592/4885TSHR 2598/4885KMT2A 2479/4885
US-20230135545-A1 BIOMIMETIC G-QUARTET COMPOUNDS PYM1, B4GALT1, NGLY1 MEN1 58/4885TSHR 3477/4885KMT2A 1478/4885
US-20130231480-A1 SEQUENCE SPECIFIC DOUBLE-STRANDED DNA/RNA BINDING COMPOUNDS AND USES THEREOF POLM, POLRMT, DDB1 MEN1 4509/4885TSHR 2534/4885KMT2A 2064/4885

“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.