SCHEMBL3133523

SCHEMBL3133523

CCOC(=O)CN(CCNS(=O)(=O)c1nc2ccccc2s1)C(=O)Cn1cnc2c(=O)[nH]c(NC(=O)OCc3ccc(OC)c(OC)c3)nc21

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.37
POLB P06746 1/20 0.33
ABL1 P00519 1/20 0.33
RIN1 Q13671 1/20 0.33
LMNA P02545 1/20 0.33
ALDH1A1 P00352 3/20 0.32
MAPT P10636 2/20 0.32
SSTR5 P35346 2/20 0.32
HPRT1 P00492 1/20 0.32
KDM4E B2RXH2 1/20 0.32
PKM P14618 1/20 0.32
TP53 P04637 1/20 0.31
GPX4 P36969 1/20 0.31
EGFR P00533 1/20 0.31

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
SCHEMBL4847336 0.94 ABL1 (0.34) KDRABL1RIN1LMNAALDH1A1
SCHEMBL3137655 0.93 KDR (0.32) KDRPOLBLMNAALDH1A1MAPT
SCHEMBL3136494 0.90 SMN1; SMN2 (0.34) POLBLMNAALDH1A1MAPTKDM4E
SCHEMBL3137591 0.88 KDR (0.38) KDRPOLBABL1RIN1LMNA
SCHEMBL4834952 0.87 PKM (0.33) POLBLMNAALDH1A1MAPTKDM4E
SCHEMBL3138127 0.87 MEN1 (0.34) POLBLMNAALDH1A1MAPTHPRT1
SCHEMBL3127038 0.86 HPRT1 (0.33) KDRPOLBLMNAALDH1A1MAPT
SCHEMBL4834803 0.84 TSHR (0.33) POLBLMNAALDH1A1MAPTKDM4E
SCHEMBL4407963 0.84 ABL1 (0.48) KDRPOLBABL1RIN1ALDH1A1
SCHEMBL4838681 0.82 ABL1 (0.34) KDRPOLBABL1RIN1LMNA

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 KDR 2819/4885POLB 50/4885ABL1 2319/4885
US-20050283005-A1 PNA monomer and precursor PNISR, RNGTT, POLL KDR 2966/4885POLB 43/4885ABL1 2566/4885
US-20050250785-A1 PNA monomer and precursor PNISR, RNGTT, POLL KDR 2966/4885POLB 43/4885ABL1 2566/4885
US-20030225252-A1 PNA monomer and precursor PNISR, RNGTT, NCL KDR 3189/4885POLB 81/4885ABL1 2254/4885
US-20060008835-A1 PNA monomer and precursor PNISR, RNGTT, POLL KDR 2966/4885POLB 43/4885ABL1 2566/4885
US-20050250786-A1 PNA monomer and precursor PNISR, RNGTT, NPR1 KDR 1972/4885POLB 53/4885ABL1 1741/4885
US-20060003374-A1 Method of making PNA oligomers RNGTT, POLL, PNISR KDR 3058/4885POLB 32/4885ABL1 2667/4885

“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.