SCHEMBL563769

SCHEMBL563769

CCc1ccc2nc3ccc(=O)cc-3oc2c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 13/20 0.66
CYP1A2 P05177 1/20 0.66
ELANE P08246 2/20 0.37
MAPT P10636 3/20 0.37
KDM4E B2RXH2 2/20 0.37
MEN1 O00255 2/20 0.37
ALDH1A1 P00352 2/20 0.37
RAB9A P51151 2/20 0.37
KMT2A Q03164 2/20 0.37
ALPL P05186 1/20 0.37
POLB P06746 1/20 0.37
ALPI P09923 1/20 0.37
ALPG P10696 1/20 0.37
RECQL P46063 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
NPC1 O15118 1/20 0.35
TP53 P04637 1/20 0.35
HPGD P15428 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 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
SCHEMBL10167845 0.86 APP (0.68) APPCYP1A2MAPTKDM4EMEN1
SCHEMBL738742 0.85 APP (0.59) APPCYP1A2MAPT
SCHEMBL7002876 0.85 APP (0.66) APPCYP1A2MAPTKDM4EMEN1
SCHEMBL6998321 0.85 APP (0.67) APPCYP1A2MAPTKDM4EMEN1
SCHEMBL7601681 0.84 APP (0.58) APPCYP1A2MAPT
SCHEMBL19831443 0.84 APP (0.59) APPCYP1A2MAPTMEN1RAB9A
SCHEMBL10208641 0.83 APP (0.64) APPCYP1A2MAPTKDM4EMEN1
SCHEMBL1094100 0.82 APP (0.59) APPCYP1A2MAPTKDM4EMEN1
SCHEMBL9537836 0.82 APP (0.59) APPCYP1A2MAPTKDM4EMEN1
Water SCHEMBL18894321 0.81 APP (0.58) APPCYP1A2MAPTKDM4EMEN1

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230227477-A1 COMPOUNDS FOR SENSING REACTIVE OXYGEN SPECIES AND METHODS FOR USING THE SAME UNIV WAKE FOREST HEALTH SCIENCES (US) 2023-07-20 US disclosed
US-9216974-B2 Phenoxazine derivatives and methods of use thereof WASHINGTON UNIVERSITY (US) 2015-12-22 US disclosed
US-9115099-B2 Phenoxazine derivatives and methods of use thereof WASHINGTON UNIVERSITY (US) 2015-08-25 US disclosed
US-20150175589-A1 PHENOXAZINE DERIVATIVES AND METHODS OF USE THEREOF UNIV WASHINGTON (US) 2015-06-25 US disclosed
US-20140221647-A1 PHENOXAZINE DERIVATIVES AND METHODS OF USE THEREOF WASHINGTON UNIVERSITY 2014-08-07 US disclosed
US-8735575-B2 Phenoxazine derivatives and methods of use thereof WASHINGTON UNIVERSITY (US) 2014-05-27 US disclosed
US-8153828-B2 Optical molecular sensors for cytochrome P450 activity Life Technologies Corporation (US) 2012-04-10 US disclosed
US-8114904-B2 Luminescence quenchers and fluorogenic probes for detection of reactive species Versitech Limited & Morningside Ventures Limited (CN) 2012-02-14 US disclosed
US-20120035359-A1 PHENOXAZINE DERIVATIVES AND METHODS OF USE THEREOF THE WASHINGTON UNIVERSITY (US) 2012-02-09 US disclosed
US-20100105095-A1 Optical Molecular Sensors for Cytochrome P450 Activity Life Technologies Corporation (US) 2010-04-29 US disclosed
US-20070072256-A1 OPTICAL MOLECULAR SENSORS FOR CYTOCHROME P450 ACTIVITY INVITROGEN CORPORATION 2007-03-29 US disclosed
US-7132252-B2 Comprises fluorophores selected from 7-hydroxycoumarin derivtives, resorufin, and a fluorescein; drug screening INVITROGEN CORPORATION (US) 2006-11-07 US disclosed
US-6638713-B2 Measurement of cytochrome enzymatic activity; obtain sample containing cytochrome, incubate with labeled substrate, monitor adjustments in optical signal, compare to control, quantify AURORA BIOSCIENCES CORPORATION 2003-10-28 US disclosed
EP-1140888-B1 OPTICAL MOLECULAR SENSORS FOR CYTOCHROME P450 ACTIVITY VERTEX PHARMA SAN DIEGO LLC (US) 2003-05-14 EP disclosed
US-20030027238-A1 Optical molecular sensors for cytochrome P450 activity Life Technologies Corporation 2003-02-06 US disclosed
US-6514687-B1 Screening a candidate compound for activity as a Cytochrome P450 enzyme substrate by contacting the compound, enzyme, and a reagent chromogen comprising the ether of a phenolic dye such as a coumarin, resofurin or fluorescein dye VERTEX PHARMACEUTICALS (SAN DIEGO), LLC 2003-02-04 US disclosed
US-6420130-B1 CHEMICAL COMPOUND FOR USE IN THE DETECTION OF PREFERENTIAL ENZYMATIC POLYPEPTIDE AURORA BIOSCIENCES CORPORATION 2002-07-16 US disclosed
EP-1140888-A1 OPTICAL MOLECULAR SENSORS FOR CYTOCHROME P450 ACTIVITY Aurora Biosciences Corporation (US) 2001-10-10 EP disclosed
US-6143492-A COMPOUND USEFUL AS AN OPTICAL PROBE; DRUG SCREENING AURORA BIOSCIENCES CORPORATION (US) 2000-11-07 US disclosed
WO-2000035900-A1 OPTICAL MOLECULAR SENSORS FOR CYTOCHROME P450 ACTIVITY AURORA BIOSCIENCES CORPORATION (US) 2000-06-22 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 (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-20140221647-A1 PHENOXAZINE DERIVATIVES AND METHODS OF USE THEREOF PPOX, CYP4Z1, PRDX2 APP 3242/4885CYP1A2 12/4885ELANE 2019/4885
US-20150175589-A1 PHENOXAZINE DERIVATIVES AND METHODS OF USE THEREOF PPOX, CYP4Z1, PRDX2 APP 3242/4885CYP1A2 12/4885ELANE 2019/4885
US-20100105095-A1 Optical Molecular Sensors for Cytochrome P450 Activity CYP2J2, CYP1A2, CYP2B6 APP 3233/4885CYP1A2 2/4885ELANE 4246/4885
US-20120035359-A1 PHENOXAZINE DERIVATIVES AND METHODS OF USE THEREOF PPOX, CYP4Z1, PRDX2 APP 3242/4885CYP1A2 12/4885ELANE 2019/4885
US-20230227477-A1 COMPOUNDS FOR SENSING REACTIVE OXYGEN SPECIES AND METHODS FOR USING THE SAME ROS1, GPX4, NOX4 APP 1854/4885CYP1A2 2507/4885ELANE 1392/4885

“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.