SCHEMBL3494397

SCHEMBL3494397

CN(C)c1ccc2cc3c(cc2c1)C(=O)NC3=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
TERT O14746 1/20 0.42
APP P05067 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
EGFR P00533 2/20 0.40
PSMB5 P28074 3/20 0.39
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
PGR P06401 2/20 0.38
METAP1 P53582 1/20 0.38
CYP3A4 P08684 1/20 0.37
HPGD P15428 1/20 0.37
HIF1A Q16665 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
PPOX P50336 1/20 0.37
SRC P12931 1/20 0.37
PIM1 P11309 1/20 0.37

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
SCHEMBL372275 0.82 ALDH1A1 (0.58) ALDH1A1KDM4EMAOAMAOBEGFR
SCHEMBL4173477 0.81 TERT (0.42) ALDH1A1TERTAPPKDM4EMAOA
SCHEMBL3502484 0.78 KDM4E (0.44) ALDH1A1TERTAPPKDM4EPDE3B
SCHEMBL12566471 0.77 TERT (0.64) ALDH1A1TERTAPPKDM4EEGFR
SCHEMBL22372457 0.73 ALDH1A1 (0.51) ALDH1A1APPKDM4EEGFRMETAP1
SCHEMBL17080971 0.73 TERT (0.42) ALDH1A1TERTAPPKDM4EMAOB
SCHEMBL7286859 0.72 GSTP1 (0.55) ALDH1A1KDM4EMAOAMAOBEGFR
SCHEMBL2025835 0.71 TERT (0.58) ALDH1A1TERTAPPKDM4EEGFR
SCHEMBL3085755 0.71 GSK3B (0.56) ALDH1A1KDM4EMAOAMAOBEGFR
SCHEMBL29540906 0.71 GSK3B (0.62) ALDH1A1KDM4EMAOAMAOBEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8445291-B2 Method for detecting target substance, and tag, DNA, vector, probe and detection kit for use therewith NATIONAL UNIVERSITY CORPORATION TOKYO MEDICAL AND DENTAL UNIVERSITY (JP) 2013-05-21 US claimed
US-20230392186-A1 METHOD AND DEVICE FOR DETECTING TRANSGLUTAMINASES Technische Universität Darmstadt (DE) 2023-12-07 US disclosed
EP-4286528-A1 METHOD AND DEVICE FOR DETECTING TRANSGLUTAMINASES Technische Universität Darmstadt (DE) 2023-12-06 EP disclosed
US-20230303635-A1 DIAGNOSTIC METHODS AND COMPOSITIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-09-28 US disclosed
EP-4200341-A1 DIAGNOSTIC METHODS AND COMPOSITIONS The Regents of the University of California (US) 2023-06-28 EP disclosed
WO-2022040484-A1 DIAGNOSTIC METHODS AND COMPOSITIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-02-24 WO disclosed
US-8445291-B2 Method for detecting target substance, and tag, DNA, vector, probe and detection kit for use therewith NATIONAL UNIVERSITY CORPORATION TOKYO MEDICAL AND DENTAL UNIVERSITY (JP) 2013-05-21 US disclosed
US-8440835-B2 Environmentally sensitive fluorophores MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2013-05-14 US disclosed
US-20100168428-A1 ENVIRONMENTALLY SENSITIVE FLUOROPHORES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2010-07-01 US disclosed
US-20100075434-A1 Method for detecting target substance, and tag, DNA, vector, probe and detection kit for use therewith NATIONAL UNIVERSITY CORPORATION TOKYO MEDICAL AND DENTAL UNIVERSITY (JP) 2010-03-25 US disclosed
US-20090035796-A1 Enzyme sensors including environmentally sensitive or fluorescent labels and uses thereof THE ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY 2009-02-05 US disclosed
EP-1869206-A2 ENZYME SENSORS INCLUDING ENVIRONMENTALLY SENSITIVE OR FLUORESCENT LABELS AND USES THEREOF ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 2007-12-26 EP disclosed
US-20060211075-A1 Enzyme sensors including environmentally sensitive or fluorescent labels and uses thereof THE ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY 2006-09-21 US disclosed
WO-2006094116-A2 ENZYME SENSORS INCLUDING ENVIRONMENTALLY SENSITIVE OR FLUORESCENT LABELS AND USES THEREOF THE ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNIVERSITY (US) 2006-09-08 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 (1 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-20100168428-A1 ENVIRONMENTALLY SENSITIVE FLUOROPHORES PTMS, IK, PHAX ALDH1A1 4233/4885TERT 2525/4885APP 266/4885

“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.