SCHEMBL2637286

SCHEMBL2637286

CCC(OC(N)=O)c1ccc(N=Nc2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.43
RAB9A P51151 6/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
TRPA1 O75762 1/20 0.41
SMN1; SMN2 Q16637 5/20 0.40
NPC1 O15118 4/20 0.40
MEN1 O00255 3/20 0.40
ALDH1A1 P00352 3/20 0.40
KMT2A Q03164 3/20 0.40
LMNA P02545 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
HPGD P15428 1/20 0.39
ADRB1 P08588 1/20 0.39
HTR2A P28223 1/20 0.39
HTR2B P41595 1/20 0.39
SIGMAR1 Q99720 1/20 0.39

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
SCHEMBL28571619 0.86 CYP1A2 (0.49) SMN1; SMN2ADRB1HTR2AHTR2BSIGMAR1
SCHEMBL514164 0.86 CYP1A2 (0.49) SMN1; SMN2ADRB1HTR2AHTR2BSIGMAR1
SCHEMBL2634575 0.83 PTGS2 (0.46) MAPTL3MBTL1SMN1; SMN2
SCHEMBL994450 0.80 MAPT (0.46) MAPTRAB9AL3MBTL1CASP3SENP8
SCHEMBL994448 0.80 MAPT (0.46) MAPTRAB9AL3MBTL1CASP3SENP8
SCHEMBL28603686 0.78 ALOX5 (0.46) MAPTSMN1; SMN2MEN1ALDH1A1KMT2A
SCHEMBL28556997 0.76 CYP1A2 (0.46) MAPTRAB9AL3MBTL1CASP3SENP8
SCHEMBL21835014 0.76 MAPT (0.38) MAPTRAB9AL3MBTL1CASP3SENP8
SCHEMBL113258 0.75 PPARA (0.44) MAPTRAB9AL3MBTL1CASP3SENP8
SCHEMBL28243883 0.75 PPARA (0.44) MAPTRAB9AL3MBTL1CASP3SENP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4404942-A2 COMPOSITIONS FOR EDITING MECP2 TRANSCRIPTS AND METHODS THEREOF Wave Life Sciences Ltd. (SG) 2024-07-31 EP disclosed
WO-2023096904-A2 C-16 MODIFIED TRIOXACARCINS, ANTIBODY DRUG CONJUGATES, AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2023-06-01 WO disclosed
EP-4164752-A1 INHIBITORS OF TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) AND USES THEREOF Dana-Farber Cancer Institute, Inc. (US) 2023-04-19 EP disclosed
WO-2023049218-A1 DOUBLE STRANDED OLIGONUCLEOTIDE COMPOSITIONS AND METHODS RELATING THERETO WAVE LIFE SCIENCES LTD. (SG) 2023-03-30 WO disclosed
WO-2023049477-A2 COMPOSITIONS FOR EDITING MECP2 TRANSCRIPTS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2023-03-30 WO disclosed
EP-4081527-A1 THE COMBINATION OF CYCLIN DEPENDENT KINASE 7 INHIBITOR AND IMMUNOTHERAPY FOR TREATMENT OF CANCER Dana-Farber Cancer Institute, Inc. (US) 2022-11-02 EP disclosed
WO-2021234459-A9 DOUBLE STRANDED OLIGONUCLEOTIDE COMPOSITIONS AND METHODS RELATING THERETO WAVE LIFE SCIENCES LTD. (SG) 2022-02-03 WO disclosed
WO-2021252708-A1 STABILIZED TRIOXACARCIN ANTIBODY DRUG CONJUGATES AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2021-12-16 WO disclosed
WO-2021133601-A1 THE COMBINATION OF CYCLIN DEPENDENT KINASE 7 INHIBITOR AND IMMUNOTHERAPY FOR TREATMENT OF CANCER DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-07-01 WO disclosed
EP-3307728-A1 COMBINATION THERAPY OF TRANSCRIPTION INHIBITORS AND KINASE INHIBITORS Dana Farber Cancer Institute, Inc. (US) 2018-04-18 EP disclosed
WO-2017190038-A1 ANALOGS OF YOHIMBINE AND USES THEREOF UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2017-11-02 WO disclosed
WO-2016201370-A1 COMBINATION THERAPY OF TRANSCRIPTION INHIBITORS AND KINASE INHIBITORS DANA-FARBER CANCER INSTITUTE, INC. (US) 2016-12-15 WO disclosed
WO-2016154317-A2 POLYMERS, HYDROGELS, AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2016-09-29 WO disclosed
WO-2016115463-A1 INHIBITORS OF PHOSPHOGLYCERATE DEHYDROGENASE (PHGDH) AND USES THEREOF WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2016-07-21 WO disclosed
WO-2016081732-A1 THIENOPYRIMIDINES AND USES THEREOF MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2016-05-26 WO disclosed
EP-2438046-A2 O-GLCNAC TRANSFERASE INHIBITORS AND USES THEREOF President and Fellows of Harvard College (US) 2012-04-11 EP disclosed
WO-2010141074-A2 O-GLCNAC TRANSFERASE INHIBITORS AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2010-12-09 WO disclosed