SCHEMBL5493701

SCHEMBL5493701

Oc1ccc(-c2cc[c]cc2)cc1I

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.41
ALOX5 P09917 3/20 0.40
MCL1 Q07820 2/20 0.37
ACMSD Q8TDX5 2/20 0.37
DHFR P00374 1/20 0.37
HNF4A P41235 1/20 0.37
QDPR P09417 3/20 0.36
SNCA P37840 1/20 0.36
MEN1 O00255 2/20 0.35
ALOX15 P16050 2/20 0.35
KMT2A Q03164 2/20 0.35
HSD17B10 Q99714 2/20 0.35
ESR2 Q92731 2/20 0.35
KDM4E B2RXH2 1/20 0.35
USP2 O75604 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
HSP90AA1 P07900 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL19880348 0.84 APP (0.55) APPALOX5MCL1ACMSDDHFR
SCHEMBL13590994 0.80 ALOX5 (0.62) APPALOX5MEN1KMT2AESR2
SCHEMBL498309 0.80 APP (0.67) APPALOX5QDPRSNCAALOX15
SCHEMBL326717 0.78 ALOX5 (0.64) APPALOX5MCL1ACMSDDHFR
SCHEMBL2785702 0.76 MMP3 (0.55) APPESR2ESR1
SCHEMBL8994752 0.76 SNCA (0.47) APPALOX5QDPRSNCAMEN1
SCHEMBL19314123 0.72 HSD17B1 (0.55) APPMCL1ESR2HSD17B1HSD17B2
SCHEMBL16317469 0.72 MAPT (0.44) APPMEN1ALOX15KMT2AHSD17B10
SCHEMBL27922800 0.72 HSD17B1 (0.55) MCL1ESR2HSD17B1HSD17B2CYP3A4
SCHEMBL7125883 0.72 MMP3 (0.66) ALOX5MEN1KMT2AESR2ESR1

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-1783221-A1 Production of adenine nucleotide translocator (ANT), novel ANT ligands and screening assays therefor MIGENIX Corp. (US) 2007-05-09 EP disclosed
US-7001729-B2 Production of adenine nucleotide translocator (ANT), novel ANT ligands and screening assays therefor MIGENIX CORP. (US) 2006-02-21 US disclosed
US-6906174-B2 Production of adenine nucleotide translocator (ANT), novel ANT ligands and screening assays therefor MIGENIX CORP. (US) 2005-06-14 US disclosed
US-6906175-B2 Production of adenine nucleotide translocator (ANT), novel ANT ligands and screening assays therefor. MIGENIX CORP. (US) 2005-06-14 US disclosed
US-6902908-B2 Production of adenine nucleotide translocator (ANT), novel ANT ligands and screening assays therefor MIGENIX CORP. (US) 2005-06-07 US disclosed
US-6887670-B2 Production of adenine nucleotide translocator (ANT), novel ANT ligands and screening assays therefor MIGENIX CORP. (US) 2005-05-03 US disclosed
US-20050064530-A1 PRODUCTION OF ADENINE NUCLEOTIDE TRANSLOCATOR (ANT), NOVEL ANT LIGANDS AND SCREENING ASSAYS THEREFOR MIGENIX CORP. 2005-03-24 US disclosed
US-20050019835-A1 PRODUCTION OF ADENINE NUCLEOTIDE TRANSLOCATOR (ANT), NOVEL ANT LIGANDS AND SCREENING ASSAYS THEREFOR MIGENIX CORP. 2005-01-27 US disclosed
US-20050003353-A1 PRODUCTION OF ADENINE NUCLEOTIDE TRANSLOCATOR (ANT), NOVEL ANT LIGANDS AND SCREENING ASSAYS THEREFOR MIGENIX CORP. 2005-01-06 US disclosed
US-20050003352-A1 PRODUCTION OF ADENINE NUCLEOTIDE TRANSLOCATOR (ANT), NOVEL ANT LIGANDS AND SCREENING ASSAYS THEREFOR MIGENIX CORP. 2005-01-06 US disclosed
US-20040241801-A1 Production of adenine nucleotide translocator (ANT), novel ANT ligands and screening assays therefor MITOKOR, INC. 2004-12-02 US disclosed
EP-1283884-A2 PRODUCTION OF ADENINE NUCLEOTIDE TRANSLOCATOR (ANT), NOVEL ANT LIGANDS AND SCREENING ASSAYS THEREFOR MITOKOR (US) 2003-02-19 EP disclosed
US-20020012992-A1 Production of adenine nucleotide translocator (ANT), novel ANT ligands and screening assays therefor MIGENIX CORP. 2002-01-31 US disclosed
US-20010044144-A1 Production of adenine nucleotide translocator (ANT), novel ANT ligands and screening assays therefor MIGENIX CORP. 2001-11-22 US disclosed
WO-2001085944-A2 PRODUCTION OF ADENINE NUCLEOTIDE TRANSLOCATOR (ANT), NOVEL ANT LIGANDS AND SCREENING ASSAYS THEREFOR MITOKOR (US) 2001-11-15 WO disclosed
WO-2000026370-A9 ADENINE NUCLEOTIDE TRANSLOCATOR (ANT) FUSION PROTEINS AND USES THEREOF MITOKOR (US) 2001-11-15 WO disclosed
EP-1049780-A1 ADENINE NUCLEOTIDE TRANSLOCATOR (ANT) FUSION PROTEINS AND USES THEREOF MITOKOR (US) 2000-11-08 EP disclosed
WO-2000026370-A2 ADENINE NUCLEOTIDE TRANSLOCATOR (ANT) FUSION PROTEINS AND USES THEREOF MITOKOR (US) 2000-05-11 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 (6 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-20010044144-A1 Production of adenine nucleotide translocator (ANT), novel ANT ligands and screening assays therefor GART, TMEM165, SLC43A3 APP 2124/4885ALOX5 3265/4885MCL1 4222/4885
US-20050003353-A1 PRODUCTION OF ADENINE NUCLEOTIDE TRANSLOCATOR (ANT), NOVEL ANT LIGANDS AND SCREENING ASSAYS THEREFOR GART, TMEM165, SLC43A3 APP 2124/4885ALOX5 3265/4885MCL1 4222/4885
US-20040241801-A1 Production of adenine nucleotide translocator (ANT), novel ANT ligands and screening assays therefor GART, TMEM165, SLC43A3 APP 2124/4885ALOX5 3265/4885MCL1 4222/4885
US-20050003352-A1 PRODUCTION OF ADENINE NUCLEOTIDE TRANSLOCATOR (ANT), NOVEL ANT LIGANDS AND SCREENING ASSAYS THEREFOR GART, TMEM165, SLC43A3 APP 2124/4885ALOX5 3265/4885MCL1 4222/4885
US-20050064530-A1 PRODUCTION OF ADENINE NUCLEOTIDE TRANSLOCATOR (ANT), NOVEL ANT LIGANDS AND SCREENING ASSAYS THEREFOR GART, TMEM165, SLC43A3 APP 2124/4885ALOX5 3265/4885MCL1 4222/4885
US-20020012992-A1 Production of adenine nucleotide translocator (ANT), novel ANT ligands and screening assays therefor GART, TMEM165, SLC43A3 APP 2124/4885ALOX5 3265/4885MCL1 4222/4885

“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.