SCHEMBL3127482

SCHEMBL3127482

CSCCOC(=O)Nc1ncnc2c1ncn2CC(=O)O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
MARS1 P56192 3/20 0.39
FLT4 P35916 1/20 0.39
KDR P35968 1/20 0.39
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
P2RY1 P47900 2/20 0.37
HDAC1 Q13547 3/20 0.37
HDAC2 Q92769 3/20 0.37
EGFR P00533 1/20 0.36
PRMT5 O14744 2/20 0.36
WDR77 Q9BQA1 2/20 0.36

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
SCHEMBL24540240 0.80 TDP1 (0.42) MKNK1TDP1FLT4KDRPDE4A
SCHEMBL3130095 0.79 TDP1 (0.48) TDP1FLT4KDRPDE4APDE4B
SCHEMBL3134619 0.77 MEN1 (0.52)
SCHEMBL3134558 0.77 HDAC1 (0.50) TDP1FLT4KDRPDE4APDE4B
SCHEMBL3138201 0.75 LMNA (0.44) MKNK1TDP1FLT4KDRPDE4A
SCHEMBL3133440 0.74 TDP1 (0.43) TDP1FLT4KDRPDE4APDE4B
SCHEMBL30089845 0.74 TDP1 (0.43) TDP1FLT4KDRPDE4APDE4B
SCHEMBL14086262 0.73 MKNK1 (0.38) MKNK1TDP1FLT4KDRPDE4A
SCHEMBL3457849 0.72 EGFR (0.54) TDP1FLT4KDRPDE4APDE4B
SCHEMBL6748343 0.72 HDAC1 (0.58) FLT4KDRHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2174936-B1 PNA monomer and precursor PANAGENE INC (KR) 2013-09-04 EP disclosed
EP-2174936-A1 PNA monomer and precursor Panagene, Inc. (KR) 2010-04-14 EP disclosed
EP-1501812-B1 PNA MONOMER AND PRECURSOR PANAGENE INC (KR) 2009-12-30 EP 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
US-7179896-B2 Method of making PNA oligomers PANAGENE, INC. (KR) 2007-02-20 US disclosed
US-7145006-B2 PNA monomer and precursor PANAGENE, INC. (KR) 2006-12-05 US disclosed
US-7125994-B2 PNA monomer and precursor PANAGENE, INC. (KR) 2006-10-24 US disclosed
EP-1501812-A4 PNA MONOMER AND PRECURSOR PANAGENE INC (KR) 2006-05-24 EP disclosed
US-20060030709-A1 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) 2006-02-09 US disclosed
US-20060008835-A1 PNA monomer and precursor KIM SUNG K 2006-01-12 US disclosed
US-20060003374-A1 Method of making PNA oligomers KIM SUNG K 2006-01-05 US disclosed
US-20050283005-A1 PNA monomer and precursor KIM SUNG K 2005-12-22 US disclosed
US-6969766-B2 PNA monomer and precursor PANAGENE, INC. (KR) 2005-11-29 US disclosed
US-20050250785-A1 PNA monomer and precursor PANAGENE, INC. (KR) 2005-11-10 US disclosed
US-20050250786-A1 PNA monomer and precursor PANAGENE, INC. (KR) 2005-11-10 US disclosed
EP-1501812-A1 PNA MONOMER AND PRECURSOR Panagene, Inc. (KR) 2005-02-02 EP disclosed
US-20030225252-A1 PNA monomer and precursor PANAGENE, INC. (KR) 2003-12-04 US disclosed
WO-2003091231-A1 PNA MONOMER AND PRECURSOR PANAGENE, INC. (US) 2003-11-06 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 (7 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-20060030709-A1 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 RNGTT, POLL, RNMT MKNK1 3099/4885TDP1 1008/4885MARS1 29/4885
US-20050283005-A1 PNA monomer and precursor PNISR, RNGTT, POLL MKNK1 2287/4885TDP1 862/4885MARS1 51/4885
US-20050250785-A1 PNA monomer and precursor PNISR, RNGTT, POLL MKNK1 2287/4885TDP1 862/4885MARS1 51/4885
US-20030225252-A1 PNA monomer and precursor PNISR, RNGTT, NCL MKNK1 2181/4885TDP1 628/4885MARS1 62/4885
US-20060008835-A1 PNA monomer and precursor PNISR, RNGTT, POLL MKNK1 2287/4885TDP1 862/4885MARS1 51/4885
US-20050250786-A1 PNA monomer and precursor PNISR, RNGTT, NPR1 MKNK1 2401/4885TDP1 727/4885MARS1 79/4885
US-20060003374-A1 Method of making PNA oligomers RNGTT, POLL, PNISR MKNK1 3216/4885TDP1 711/4885MARS1 49/4885

“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.