SCHEMBL3817867

SCHEMBL3817867

CCOC(=O)CNCCNS(=O)(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP14 Q460N5 1/20 0.48
GAA P10253 2/20 0.47
MAPT P10636 5/20 0.45
LMNA P02545 4/20 0.45
KMT2A Q03164 2/20 0.45
NFKBIA P25963 2/20 0.44
RELA Q04206 2/20 0.44
POLB P06746 1/20 0.43
THRB P10828 1/20 0.43
VDR P11473 1/20 0.43
MMP2 P08253 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SLC40A1 Q9NP59 1/20 0.41
IDH1 O75874 1/20 0.41
MEN1 O00255 1/20 0.41
PKM P14618 1/20 0.41
FLT1 P17948 1/20 0.40
FLT4 P35916 1/20 0.40
KDR P35968 1/20 0.40
CYP3A4 P08684 1/20 0.40

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
SCHEMBL3815024 0.87 MAPT (0.43) MAPTLMNATHRBSLC40A1IDH1
SCHEMBL3812561 0.87 LMNA (0.43) MAPTLMNAKMT2ANFKBIARELA
SCHEMBL3815831 0.85 MAPT (0.44) MAPTLMNAKMT2APOLBTHRB
SCHEMBL3817262 0.82 ALDH1A1 (0.51) LMNAKMT2ATHRBMMP2SMN1; SMN2
Acetic Acid SCHEMBL3821422 0.77 PARP14 (0.51) PARP14GAAMAPTLMNAKMT2A
SCHEMBL27681866 0.77 PARP14 (0.50) PARP14GAAMAPTLMNAKMT2A
SCHEMBL3823623 0.77 LMNA (0.46) GAAMAPTLMNAKMT2APOLB
SCHEMBL7017836 0.76 MAPT (0.53) GAAMAPTLMNAKMT2ASMN1; SMN2
SCHEMBL3815159 0.74 KMT2A (0.54) GAAMAPTLMNAKMT2AMMP2
SCHEMBL3820739 0.74 PARP14 (0.40) PARP14GAAMAPTLMNAKMT2A

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
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
CN-100351243-C Peptide nucleic acid oligomers from 1-benzenesulfonyl-3-amino acid side chain-4- (2-nucleobase acetyl) -piperazin-2-one PANAGENE INC (KR) 2007-11-28 CN disclosed
US-7022851-B2 PNA monomer and precursor PANAGENE, INC. (KR) 2006-04-04 US disclosed
CN-1642923-A Peptide nucleic acid oligomers from 1-benzenesulfonyl-3-amino acid side chain-4-(2-nucleobase(acetyl))-piperazin-2-ones PANAGENE INC (KR) 2005-07-20 CN disclosed
EP-1470114-A4 PEPTIDE NUCLEIC ACID OLIGOMERS FROM 1-BENZENESULFONYL-3-AMINO ACID SIDE CHAIN-4-(2-NUCLEOBASE(ACETYL))-PIPERAZIN-2-ONES PANAGENE INC (KR) 2005-05-11 EP disclosed
EP-1470114-A1 PEPTIDE NUCLEIC ACID OLIGOMERS FROM 1-BENZENESULFONYL-3-AMINO ACID SIDE CHAIN-4-(2-NUCLEOBASE(ACETYL))-PIPERAZIN-2-ONES Panagene, Inc. (KR) 2004-10-27 EP disclosed
US-20030195332-A1 PNA monomer and precursor PANAGENE, INC. (KR) 2003-10-16 US disclosed
WO-2003062212-A1 PEPTIDE NUCLEIC ACID OLIGOMERS FROM 1-BENZENESULFONYL-3-AMINO ACID SIDE CHAIN-4-(2-NUCLEOBASE(ACETYL))-PIPERAZIN-2-ONES PANAGENE, INC. (US) 2003-07-31 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 (1 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-20030195332-A1 PNA monomer and precursor RNGTT, NGLY1, NCL PARP14 519/4885GAA 3495/4885MAPT 4430/4885

“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.