SCHEMBL10105031

SCHEMBL10105031

Cc1cn(C)c(N)nc1=O

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HSD17B10 Q99714 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
CYP2C19 P33261 1/20 0.33
ATAD2 Q6PL18 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
CASP1 P29466 1/20 0.31
BRPF1 P55201 1/20 0.31
AURKA O14965 1/20 0.30
TTK P33981 1/20 0.30
AURKB Q96GD4 1/20 0.30
INCENP Q9NQS7 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
SCHEMBL27054278 0.82 ALDH1A1 (0.33) ALDH1A1
SCHEMBL18660035 0.77 LMNA (0.34) KDM4EALDH1A1HPGD
SCHEMBL3786997 0.77 KDM4E (0.31) KDM4E
SCHEMBL24420781 0.77 ALDH1A1 (0.30) ALDH1A1HSD17B10MAPTTSHRCASP1
SCHEMBL17119891 0.74 SMN1; SMN2 (0.33)
SCHEMBL25970580 0.72
SCHEMBL2616842 0.72
SCHEMBL23152952 0.71 KMT2A (0.33)
SCHEMBL15215731 0.71 P2RX7 (0.33)
SCHEMBL22002659 0.70 RECQL (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3526239-B1 HIF 1-ALPHA ANTISENSE OLIGONUCLEOTIDES OLIPASS CORP (KR) 2021-11-03 EP disclosed
US-11162104-B2 SCN9A antisense pain killer OLIPASS CORPORATION (KR) 2021-11-02 US disclosed
US-20200272872-A1 Methods of Storing Information Using Nucleic Acids PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2020-08-27 US disclosed
US-20190345202-A1 ANDROGEN RECEPTOR ANTISENSE OLIGONUCLEOTIDES OLIPASS CORPORATION (KR) 2019-11-14 US disclosed
US-20190337987-A1 EXON SKIPPING BY PEPTIDE NUCLEIC ACID DERIVATIVES OLIPASS CORPORATION (KR) 2019-11-07 US disclosed
US-20190218255-A1 SCN9A ANTISENSE OLIGONUCLEOTIDES OLIPASS CORPORATION (KR) 2019-07-18 US disclosed
WO-2019043634-A2 CYCLIC DI-NUCLEOTIDES AS STIMULATOR OF INTERFERON GENES MODULATORS BEIJING XUANYI PHARMASCIENCES CO., LTD. (CN) 2019-03-07 WO disclosed
WO-2018069764-A1 HIF 1-ALPHA ANTISENSE OLIGONUCLEOTIDES OLIPASS CORPORATION (KR) 2018-04-19 WO disclosed
US-20170337324-A1 Methods for Retrievable Information Storage Using Nucleic Acids PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2017-11-23 US disclosed
US-9732110-B2 Nucleoside and nucleotide derivatives ENANTA PHARMACEUTICALS, INC. (US) 2017-08-15 US disclosed
EP-1470114-B1 PEPTIDE NUCLEIC ACID OLIGOMERS FROM 1-BENZENESULFONYL-3-AMINO ACID SIDE CHAIN-4-(2-NUCLEOBASE(ACETYL))-PIPERAZIN-2-ONES PANAGENE INC (KR) 2009-08-19 EP disclosed
US-20090131662-A1 Compositions And Methods Pertaining To PNA Synthons And Oligomers Comprising A Universal Base LIFE TECHNOLOGIES CORPORATION, A DELAWARE CORPORATION (US) 2009-05-21 US disclosed
US-7482353-B2 Compositions and methods pertaining to PNA synthons and oligomers comprising a universal base APPLIED BIOSYSTEMS INC. (US) 2009-01-27 US disclosed
US-7411065-B2 Peptide nucleic acid monomers: diphenylmethyl, benzyl, alkylthioalkyl, or phenylthioalkyl esters of N-(1-[4-(2-benzothiazolyl-, 2-benzoxazolyl-, 2-benzofuranyl- or 2-benzothiophenyl-sulfonyl)-3-piperazinon-1-ylcarbonylmethyl]pyrimidon-4-yl)carbamic acids PANAGENE, INC. (KR) 2008-08-12 US disclosed
US-7371860-B2 PNA monomer and precursor PANAGENE, INC. (KR) 2008-05-13 US disclosed
US-7371859-B2 Peptide nucleic acid monomers; 1-(4-(benzothiazolyl-, benzoxazolyl-, benzofuranyl-, and benzothiophenyl- sulfonyl)piperidin-3-one-1-ylcarbonylmethyl)adenines; suitable for automatic and parallel synthesis; increased yields PANAGENE, INC. (KR) 2008-05-13 US disclosed
EP-1307469-B1 NUCLEIC ACID BINDING COMPOUNDS CONTAINING PYRAZOLO¬3,4-D PYRIMIDINE ANALOGUES OF PURIN-2,6-DIAMINE AND THEIR USES ROCHE DIAGNOSTICS GMBH (DE) 2008-01-23 EP disclosed
EP-1873156-A1 Process for the preparation of 6-[[(alkoxy)carbonyl]amino]-9H-Purine-9-acetic acid and 4-[(alkoxycarbonyl)amino]-2-oxo-1(2H)-Pyrimidineacetic acid derivatives as synthons for the synthesis of peptide nucleic acids PerSeptive Biosystems, Inc. (US) 2008-01-02 EP disclosed
US-7211668-B2 PNA monomer and precursor PANAGENE, INC. (KR) 2007-05-01 US disclosed
US-7179896-B2 Method of making PNA oligomers PANAGENE, INC. (KR) 2007-02-20 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 (5 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-20090131662-A1 Compositions And Methods Pertaining To PNA Synthons And Oligomers Comprising A Universal Base DNMT3A, DNTT, POLI KDM4E 4709/4885ALDH1A1 4607/4885HSD17B10 4238/4885
US-20190345202-A1 ANDROGEN RECEPTOR ANTISENSE OLIGONUCLEOTIDES AR, NR5A1, NR5A2 KDM4E 4345/4885ALDH1A1 2699/4885HSD17B10 532/4885
US-20190337987-A1 EXON SKIPPING BY PEPTIDE NUCLEIC ACID DERIVATIVES PTBP1, RBM17, UPF1 KDM4E 4398/4885ALDH1A1 4196/4885HSD17B10 3248/4885
US-20190218255-A1 SCN9A ANTISENSE OLIGONUCLEOTIDES SCN9A, SCN7A, SCN8A KDM4E 4376/4885ALDH1A1 3949/4885HSD17B10 4043/4885
US-11162104-B2 SCN9A antisense pain killer SCN9A, SCN7A, SCN8A KDM4E 1281/4885ALDH1A1 3390/4885HSD17B10 4077/4885

“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.