SCHEMBL8046428

SCHEMBL8046428

O=C(O)CCCCCNC(=O)CCCCCNC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.91

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.91
LMNA P02545 1/20 0.48
TSHR P16473 1/20 0.48
HTT P42858 1/20 0.48
HDAC3 O15379 3/20 0.46
HDAC4 P56524 3/20 0.46
HDAC1 Q13547 3/20 0.46
HDAC7 Q8WUI4 3/20 0.46
HDAC2 Q92769 3/20 0.46
HDAC10 Q969S8 3/20 0.46
HDAC11 Q96DB2 3/20 0.46
HDAC8 Q9BY41 3/20 0.46
HDAC6 Q9UBN7 3/20 0.46
HDAC9 Q9UKV0 3/20 0.46
HDAC5 Q9UQL6 3/20 0.46
NCOR2 Q9Y618 1/20 0.46
EPHX2 P34913 1/20 0.45
TLR2 O60603 2/20 0.44
CASP3 P42574 1/20 0.43

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
SCHEMBL17599913 1.00 KMT2A (0.91) KMT2ALMNATSHRHTTHDAC3
SCHEMBL31652507 0.99 KMT2A (0.89) KMT2ALMNATSHRHTTHDAC3
SCHEMBL178890 0.95 KMT2A (1.00) KMT2AHTTEPHX2TLR2CASP3
SCHEMBL178760 0.95 KMT2A (1.00) KMT2AHTTEPHX2TLR2CASP3
SCHEMBL25143 0.95 KMT2A (1.00) KMT2AHTTEPHX2TLR2CASP3
SCHEMBL178761 0.95 KMT2A (1.00) KMT2AHTTEPHX2TLR2CASP3
SCHEMBL2182769 0.95 KMT2A (1.00) KMT2AHTTEPHX2TLR2CASP3
SCHEMBL17746959 0.95 KMT2A (1.00) KMT2AHTTEPHX2TLR2CASP3
SCHEMBL178759 0.95 KMT2A (1.00) KMT2AHTTEPHX2TLR2CASP3
SCHEMBL178758 0.95 KMT2A (1.00) KMT2AHTTEPHX2TLR2CASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0383803-B1 OLIGONUCLEOTIDE-POLYAMIDE CONJUGATES HOWARD FLOREY INST OF (AU) 2000-05-03 EP disclosed
EP-0972779-A2 Oligonucleotide-polyamide conjugates HOWARD FLOREY INSTITUTE OF EXPERIMENTAL PHYSIOLOGY AND MEDICINE (AU) 2000-01-19 EP disclosed
US-5854410-A Oligonucleoside cleavage compounds and therapies GENTA INCORPORATED (US) 1998-12-29 US disclosed
US-5846728-A Oligonucleotide-polyamide conjugates HOWARD FLOREY INSTITUTE OF EXPERIMENTAL PHYSIOLOGY AND MEDICINE (AU) 1998-12-08 US disclosed
EP-0542887-B1 PSORALEN CONJUGATED METHYLPHOSPHONATE OLIGONUCLEOTIDES AS THERAPEUTIC AGENTS FOR CHRONIC MYELOGENOUS LEUKEMIA GENTA INC (US) 1998-12-02 EP disclosed
US-5677440-A Oligonucleotide-polyamide conjugates HOWARD FLOREY INSTITUTE OF EXPERIMENTAL PHYSIOLOGY AND MEDICINE (AU) 1997-10-14 US disclosed
US-5525465-A Oligonucleotide-polyamide conjugates and methods of production and applications of the same HOWARD FLOREY INSTITUTE OF EXPERIMENTAL PHYSIOLOGY AND MEDICINE (AU) 1996-06-11 US disclosed
EP-0542887-A1 PSORALEN CONJUGATED METHYLPHOSPHONATE OLIGONUCLEOTIDES AS THERAPEUTIC AGENTS FOR CHRONIC MYELOGENOUS LEUKEMIA GENTA INCORPORATED (US) 1993-05-26 EP disclosed
WO-1992002641-A1 PSORALEN CONJUGATED METHYLPHOSPHONATE OLIGONUCLEOTIDES AS THERAPEUTIC AGENTS FOR CHRONIC MYELOGENOUS LEUKEMIA GENTA INCORPORATED (US) 1992-02-20 WO disclosed
WO-1992002532-A1 IMPROVED NON-NUCLEOTIDE-BASED LINKER REAGENTS FOR OLIGOMERS GENTA INCORPORATED (US) 1992-02-20 WO disclosed
EP-0383803-A4 OLIGONUCLEOTIDE-POLYAMIDE CONJUGATES 1991-03-20 EP disclosed
EP-0383803-A1 OLIGONUCLEOTIDE-POLYAMIDE CONJUGATES HOWARD FLOREY INSTITUTE OF EXPERIMENTAL PHYSIOLOGY AND MEDICINE (AU) 1990-08-29 EP disclosed
WO-1989003849-A1 OLIGONUCLEOTIDE-POLYAMIDE CONJUGATES HOWARD FLOREY INSTITUTE OF EXPERIMENTAL PHYSIOLOGY (AU) 1989-05-05 WO disclosed