SCHEMBL2851413

SCHEMBL2851413

[O-][N+]1=CNC=C2Sc3ccccc3N=C21

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.34
DRD2 P14416 1/20 0.31
TRPA1 O75762 1/20 0.30

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
SCHEMBL407792 0.67 DRD2 (0.33) BACE1DRD2TRPA1
SCHEMBL2362166 0.59 DRD2 (0.35) BACE1DRD2TRPA1
SCHEMBL4760147 0.57 TRPA1 (0.36) BACE1DRD2TRPA1
SCHEMBL4264647 0.57 DRD2 (0.36) BACE1DRD2TRPA1
SCHEMBL17865294 0.57 BACE1 (0.39) BACE1DRD2TRPA1
SCHEMBL117715 0.56 TRPA1 (0.46) BACE1DRD2TRPA1
SCHEMBL54919 0.56 TRPA1 (0.45) BACE1DRD2TRPA1
SCHEMBL29352703 0.56 TRPA1 (0.45) BACE1DRD2TRPA1
SCHEMBL24828 0.55 TRPA1 (0.54) BACE1DRD2TRPA1
SCHEMBL882180 0.54 TRPA1 (0.36) BACE1DRD2TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1851339-B1 METHODS AND COMPOSITIONS FOR DETECTING A DRUG RESISTANT EGFR MUTANT SLOAN KETTERING INST CANCER (US) 2016-05-18 EP disclosed
US-8501413-B2 Methods and compositions for detecting a drug resistant EGFR mutant MEMORIAL-SLOAN KETTERING CANCER CENTER (US) 2013-08-06 US disclosed
EP-2505591-A1 Methods and compositions for detecting a drug resistant EGFR mutant Memorial Sloan-Kettering Cancer Center (US) 2012-10-03 EP disclosed
US-20110319283-A1 OLIGONUCLEOTIDES CAPABLE OF DISCRIMINATING BETWEEN NUCLEIC ACID SEQUENCES THAT COMPRISE A CONSERVED SEQUENCE TRILLION GENOMICS LIMITED (GB) 2011-12-29 US disclosed
US-20100173285-A1 Methods and Compositions for Detecting a Drug Resistant Egfr Mutant MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2010-07-08 US disclosed
WO-2010058189-A1 OLIGONUCLEOTIDES CAPABLE OF DISCRIMINATING BETWEEN NUCLEIC ACID SEQUENCES THAT COMPRISE A CONSERVED SEQUENCE TRILLION GENOMICS LIMITED (GB) 2010-05-27 WO disclosed
EP-1851339-A4 METHODS AND COMPOSITIONS FOR DETECTING A DRUG RESISTANT EGFR MUTANT SLOAN KETTERING INST CANCER (US) 2009-05-27 EP disclosed
US-20080279920-A1 Compositions For Treating Respiratory Viral Infections and Their Use INTRADIGM CORPORATION (US) 2008-11-13 US disclosed
US-20080095747-A1 Promotion of Cell Migration and Axon Regeneration in the Cns MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2008-04-24 US disclosed
EP-1851339-A2 METHODS AND COMPOSITIONS FOR DETECTING A DRUG RESISTANT EGFR MUTANT MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2007-11-07 EP disclosed
EP-1807539-A2 EVALUATION OF THE TOXICITY OF PHARMACEUTICAL AGENTS Novartis AG (CH) 2007-07-18 EP disclosed
EP-1799272-A2 PROMOTION OF CELL MIGRATION AND AXON REGENERATION IN THE CNS MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2007-06-27 EP disclosed
US-20070065861-A1 Methods for genetic analysis of alternative splicing LEMISCHKA IHOR 2007-03-22 US disclosed
US-20070065862-A1 Methods for analysis of genetic interactions BOARD OF TRUSTEES OF PRINCETON UNIVERSITY 2007-03-22 US disclosed
WO-2006086777-A2 METHODS AND COMPOSITIONS FOR DETECTING A DRUG RESISTANT EGFR MUTANT MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2006-08-17 WO disclosed
WO-2006050124-A2 EVALUATION OF THE TOXICITY OF PHARMACEUTICAL AGENTS NOVARTIS AG (CH) 2006-05-11 WO disclosed
WO-2006042105-A2 PROMOTION OF CELL MIGRATION AND AXON REGENERATION IN THE CNS MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2006-04-20 WO disclosed
US-6503754-B1 A compound 8 to 50 nucleobases in length targeted to nucleobases 354 through 373 or nucleobases 707 through 726 of a coding region of a nucleic acid molecule encoding human BH3 Interacting domain Death agonist of SEQ ID NO: 3, nucleobases ISIS PHARMACEUTICALS, INC. 2003-01-07 US disclosed