SCHEMBL12302017

SCHEMBL12302017

Cc1cccc(C)c1-c1ccc2c(c1)sc(C=C1C=CN(Cc3ccc(CN4CCN(C)CC4)cc3)c3ccccc31)[n+]2C

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TNKS O95271 2/20 0.37
▸ PARP1 P09874 1/20 0.37
▸ CHKA P35790 6/20 0.34
▸ CHEK1 O14757 1/20 0.33
▸ KDR P35968 1/20 0.32
▸ TNIK Q9UKE5 1/20 0.32
▸ MC4R P32245 1/20 0.32
▸ IDO1 P14902 1/20 0.32
▸ TDO2 P48775 1/20 0.32
▸ IDO2 Q6ZQW0 1/20 0.32
▸ CA2 P00918 1/20 0.31
▸ NCF1 P14598 1/20 0.31
▸ PRMT6 Q96LA8 1/20 0.31
▸ SRC P12931 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ PDE2A O00408 1/20 0.31
▸ PDE10A Q9Y233 1/20 0.31

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
SCHEMBL12301955 0.91 DRD4 (0.37) CHKA
SCHEMBL12302016 0.89 KDM4E (0.32) —
SCHEMBL12302022 0.89 KDM4E (0.33) —
SCHEMBL12302020 0.86 — —
SCHEMBL12302021 0.86 — —
SCHEMBL12302031 0.85 MAP3K11 (0.41) TNIKSRC
SCHEMBL12301956 0.83 PDE4B (0.38) —
SCHEMBL12301976 0.81 — —
SCHEMBL12302046 0.81 ALDH1A1 (0.33) —
SCHEMBL12301969 0.80 HTR7 (0.32) —

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 TNKS 592/4885PARP1 86/4885CHKA 2846/4885
US-20120288855-A1 Fluorescent Chemical Compounds Having High Selectivity for Double Stranded DNA, and Methods for Their Use POLRMT, DNA2, NSUN2 TNKS 592/4885PARP1 86/4885CHKA 2846/4885
US-20100143917-A1 FLUORESCENT CHEMICAL COMPOUNDS HAVING HIGH SELECTIVITY FOR DOUBLE STRANDED DNA, AND METHODS FOR THEIR USE POLRMT, DNA2, NSUN2 TNKS 592/4885PARP1 86/4885CHKA 2846/4885
US-20150316558-A1 Fluorescent Chemical Compounds Having High Selectivity for Double Stranded DNA, and Methods for Their Use POLRMT, DNA2, NSUN2 TNKS 592/4885PARP1 86/4885CHKA 2846/4885
US-20150004597-A1 Fluorescent Chemical Compounds Having High Selectivity for Double Stranded DNA, and Methods for Their Use POLRMT, DNA2, NSUN2 TNKS 592/4885PARP1 86/4885CHKA 2846/4885

“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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