SCHEMBL12301907

SCHEMBL12301907

CSc1sc2cc(-c3cccs3)ccc2[n+]1C

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.44
▸ ERN1 O75460 1/20 0.35
▸ PRMT6 Q96LA8 1/20 0.35
▸ LTA4H P09960 1/20 0.35
▸ ACHE P22303 1/20 0.35
▸ HDAC1 Q13547 6/20 0.35
▸ HDAC2 Q92769 6/20 0.35
▸ HDAC3 O15379 5/20 0.35
▸ PGR P06401 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ SLC6A11 P48066 1/20 0.34
▸ SCD O00767 1/20 0.33
▸ TNF P01375 1/20 0.33
▸ APP P05067 1/20 0.33
▸ SNCA P37840 1/20 0.33
▸ NOD1 Q9Y239 1/20 0.33

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
SCHEMBL12301906 0.79 PIK3CA (0.37) KCNH2ACHEKDM4EALDH1A1MAPT
SCHEMBL12301904 0.78 APP (0.47) ERN1HDAC2APP
SCHEMBL12301903 0.77 ESR1 (0.39) TNFAPPSNCANOD1
SCHEMBL12301902 0.75 APP (0.36) TNFAPPSNCANOD1
SCHEMBL13838250 0.74 APP (0.33) ALDH1A1MAPTTNFAPPSNCA
SCHEMBL12301900 0.72 AR (0.36) KDM4EALDH1A1MAPTTNFAPP
SCHEMBL30924937 0.72 ALDH1A1 (0.33) ALDH1A1MAPTTNFAPPSNCA
Iodide SCHEMBL6663647 0.71 SMN1; SMN2 (0.38) ACHEKDM4EALDH1A1MAPTTNF
SCHEMBL12301901 0.70 NPC1 (0.47) MAPT
SCHEMBL4822992 0.69 MAPT (0.48) ACHEKDM4EALDH1A1MAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1885718-B1 FLUORESCENT CHEMICAL COMPOUNDS HAVING HIGH SELECTIVITY FOR DOUBLE STRANDED DNA, AND METHODS FOR THEIR USE LIFE TECHNOLOGIES CORP (US) 2017-03-15 — — EP disclosed
US-9366676-B2 Fluorescent chemical compounds having high selectivity for double stranded DNA, and methods for their use Life Technologies Corporation (US) 2016-06-14 — — US disclosed
US-20150316558-A1 Fluorescent Chemical Compounds Having High Selectivity for Double Stranded DNA, and Methods for Their Use MOLECULAR PROBES, INC. 2015-11-05 — — US disclosed
US-9115397-B2 Fluorescent chemical compounds having high selectivity for double stranded DNA, and methods for their use Life Technologies Corporation (US) 2015-08-25 — — US disclosed
US-20150004597-A1 Fluorescent Chemical Compounds Having High Selectivity for Double Stranded DNA, and Methods for Their Use LIFE TECHNOLOGIES CORP (US) 2015-01-01 — — US disclosed
US-8865904-B2 Fluorescent chemical compounds having high selectivity for double stranded DNA, and methods for their use Life Technologies Corporation (US) 2014-10-21 — — US disclosed
US-20130224735-A1 Fluorescent Chemical Compounds Having High Selectivity for Double Stranded DNA, and Methods for Their Use Life Technologies Corporation (US) 2013-08-29 — — US disclosed
US-20120288855-A1 Fluorescent Chemical Compounds Having High Selectivity for Double Stranded DNA, and Methods for Their Use Life Technologies Corporation (US) 2012-11-15 — — US disclosed
US-20110217699-A1 Fluorescent Chemical Compounds Having High Selectivity for Double Stranded DNA, and Methods for Their Use Life Technologies Corporation (US) 2011-09-08 — — US disclosed
US-7943777-B2 Fluorescent chemical compounds having high selectivity for double stranded DNA, and methods for their use Life Technologies Corporation (US) 2011-05-17 — — US disclosed
US-20100143917-A1 FLUORESCENT CHEMICAL COMPOUNDS HAVING HIGH SELECTIVITY FOR DOUBLE STRANDED DNA, AND METHODS FOR THEIR USE Life Technologies Corporation (US) 2010-06-10 — — US disclosed
US-7598390-B2 Fluorescent chemical compounds having high selectivity for double stranded DNA, and methods for their use Life Technologies Corporation (US) 2009-10-06 — — US 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 (5 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-20110217699-A1 Fluorescent Chemical Compounds Having High Selectivity for Double Stranded DNA, and Methods for Their Use POLRMT, DNA2, NSUN2 KCNH2 3866/4885ERN1 433/4885PRMT6 2945/4885
US-20120288855-A1 Fluorescent Chemical Compounds Having High Selectivity for Double Stranded DNA, and Methods for Their Use POLRMT, DNA2, NSUN2 KCNH2 3866/4885ERN1 433/4885PRMT6 2945/4885
US-20100143917-A1 FLUORESCENT CHEMICAL COMPOUNDS HAVING HIGH SELECTIVITY FOR DOUBLE STRANDED DNA, AND METHODS FOR THEIR USE POLRMT, DNA2, NSUN2 KCNH2 3866/4885ERN1 433/4885PRMT6 2945/4885
US-20150316558-A1 Fluorescent Chemical Compounds Having High Selectivity for Double Stranded DNA, and Methods for Their Use POLRMT, DNA2, NSUN2 KCNH2 3866/4885ERN1 433/4885PRMT6 2945/4885
US-20150004597-A1 Fluorescent Chemical Compounds Having High Selectivity for Double Stranded DNA, and Methods for Their Use POLRMT, DNA2, NSUN2 KCNH2 3866/4885ERN1 433/4885PRMT6 2945/4885

“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.

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