Netropsin

Netropsin

SCHEMBL4284668

Cn1cc(NC(=O)c2cc(NC(=O)CNC(=N)N)cn2C)cc1C(=O)NCCC(=N)N.Cn1ccnc1C(N)=O

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 2/20 0.60
HRAS P01112 14/20 0.58
ESR1 P03372 13/20 0.58
ESR2 Q92731 13/20 0.58
KDM4E B2RXH2 1/20 0.57
POLB P06746 1/20 0.57
MAPT P10636 1/20 0.57
HIF1A Q16665 1/20 0.57
HDAC1 Q13547 2/20 0.38
HDAC2 Q92769 2/20 0.38
HDAC8 Q9BY41 2/20 0.38
NR3C1 P04150 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
SCHEMBL14267762 0.89 TOP1 (0.74) TOP1HRASESR1ESR2KDM4E
Netropsin SCHEMBL197747 0.89 TOP1 (0.74) TOP1HRASESR1ESR2KDM4E
Netropsin SCHEMBL4953090 0.88 TOP1 (0.72) TOP1HRASESR1ESR2KDM4E
Netropsin SCHEMBL10408939 0.88 TOP1 (0.72) TOP1HRASESR1ESR2KDM4E
Netropsin SCHEMBL951644 0.87 TOP1 (0.71) TOP1HRASESR1ESR2KDM4E
SCHEMBL12348338 0.87 TOP1 (0.70) TOP1HRASESR1ESR2KDM4E
SCHEMBL12348157 0.83 TOP1 (0.65) TOP1HRASESR1ESR2KDM4E
Netropsin SCHEMBL4955084 0.81 TOP1 (0.56) TOP1HRASESR1ESR2KDM4E
SCHEMBL19288091 0.81 TOP1 (0.62) TOP1HRASESR1ESR2KDM4E
SCHEMBL30125664 0.78 HDAC1 (0.57) TOP1HRASESR1ESR2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090188002-A1 Artificial chromosomes and transchromosomic avians AVIGENICS, INC. 2009-07-23 US disclosed
WO-2006093847-A1 ARTIFICIAL CHROMOSOMES AND TRANSCHROMOSOMIC AVIANS AVIGENICS, INC. (US) 2006-09-08 WO disclosed
US-20060174364-A1 Artificial chromosomes and transchromosomic avians AVIGENICS, INC. 2006-08-03 US disclosed
EP-1144414-B1 COMPOSITIONS AND METHODS RELATING TO CYCLIC COMPOUNDS THAT UNDERGO NUCLEOTIDE BASE PAIR-SPECIFIC INTERACTIONS WITH DOUBLE-STRANDED NUCLEIC ACIDS CALIFORNIA INST OF TECHN (US) 2004-10-06 EP disclosed
US-6683189-B1 POLYAMIDE-OLIGONUCLEOTIDE CONJUGATES; NETROPSIN AND DISTAMYCIN A SYNTHESIS CALIFORNIA INSTITUTE OF TECHNOLOGY 2004-01-27 US disclosed
US-6673940-B1 Compositions and methods relating to cyclic compounds that undergo nucleotide base pair-specific interactions with double-stranded nucleic acids CALIFORNIA INSTITUTE OF TECHNOLOGY 2004-01-06 US disclosed
US-6545162-B1 Solid phase biosynthesis of viricide antibiotic CALIFORNIA INSTITUTE OF TECHNOLOGY 2003-04-08 US disclosed
WO-2000040605-A9 COMPOSITIONS AND METHODS RELATING TO CYCLIC COMPOUNDS THAT UNDERGO NUCLEOTIDE BASE PAIR-SPECIFIC INTERACTIONS WITH DOUBLE-STRANDED NUCLEIC ACIDS CALIFORNIA INST OF TECHN (US) 2001-10-25 WO disclosed
EP-1144414-A2 COMPOSITIONS AND METHODS RELATING TO CYCLIC COMPOUNDS THAT UNDERGO NUCLEOTIDE BASE PAIR-SPECIFIC INTERACTIONS WITH DOUBLE-STRANDED NUCLEIC ACIDS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2001-10-17 EP disclosed
US-6090947-A Method for the synthesis of pyrrole and imidazole carboxamides on a solid support CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2000-07-18 US disclosed
WO-2000040605-A2 COMPOSITIONS AND METHODS RELATING TO CYCLIC COMPOUNDS THAT UNDERGO NUCLEOTIDE BASE PAIR-SPECIFIC INTERACTIONS WITH DOUBLE-STRANDED NUCLEIC ACIDS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2000-07-13 WO disclosed
US-5874412-A ANTICANCER AGENTS PRIEBE WALDEMAR (US) 1999-02-23 US disclosed
EP-0885189-A2 METHOD FOR THE SYNTHESIS OF POLY-PYRROLE AND POLY-IMIDAZOLE CARBOXAMIDES ON A SOLID SUPPORT CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 1998-12-23 EP disclosed
WO-1997030975-A2 METHOD FOR THE SYNTHESIS OF POLY-PYRROLE AND POLY-IMIDAZOLE CARBOXAMIDES ON A SOLID SUPPORT CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 1997-08-28 WO disclosed
WO-1995005389-A1 SEQUENCE-SPECIFIC GLYCOCONJUGATE TRANSCRIPTIONAL ANTAGONISTS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 1995-02-23 WO disclosed