SCHEMBL498701

SCHEMBL498701

Cc1ccc2nc3c(=O)[nH]c(=O)[nH]c3nc2c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 6/20 0.66
BLM P54132 5/20 0.66
KDM4E B2RXH2 5/20 0.66
CASP7 P55210 3/20 0.66
ALDH1A1 P00352 3/20 0.66
RAB9A P51151 3/20 0.66
CYP1A2 P05177 2/20 0.66
HSD17B10 Q99714 2/20 0.66
PABPC1 P11940 1/20 0.66
ADORA2A P29274 1/20 0.66
ADORA2B P29275 1/20 0.66
CYP2C19 P33261 1/20 0.66
PMP22 Q01453 1/20 0.66
MAPT P10636 7/20 0.63
POLB P06746 4/20 0.63
PDE3B Q13370 6/20 0.55
PDE3A Q14432 6/20 0.55
MEN1 O00255 5/20 0.51
KMT2A Q03164 5/20 0.51
PKM P14618 3/20 0.51

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
SCHEMBL498444 1.00 TDP1 (0.66) TDP1BLMKDM4ECASP7ALDH1A1
Lumichrome SCHEMBL29516827 0.83 BLM (0.64) TDP1BLMKDM4ECASP7ALDH1A1
Lumichrome SCHEMBL29861572 0.83 BLM (0.64) TDP1BLMKDM4ECASP7ALDH1A1
Lumichrome SCHEMBL194906 0.83 BLM (0.64) TDP1BLMKDM4ECASP7ALDH1A1
SCHEMBL29373347 0.81 KDM4E (0.66) TDP1BLMKDM4ECASP7ALDH1A1
SCHEMBL11405850 0.81 KDM4E (0.66) TDP1BLMKDM4ECASP7ALDH1A1
SCHEMBL18048094 0.81 KDM4E (0.66) TDP1BLMKDM4ECASP7ALDH1A1
SCHEMBL18048120 0.81 KDM4E (0.66) TDP1BLMKDM4ECASP7ALDH1A1
Alloxazine SCHEMBL29516835 0.80 KDM4E (1.00) TDP1BLMKDM4ECASP7ALDH1A1
Alloxazine SCHEMBL499075 0.80 KDM4E (1.00) TDP1BLMKDM4ECASP7ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8211656-B2 Biological targeting compositions and methods of using the same THE INVENTION SCIENCE FUND I, LLC (US) 2012-07-03 US claimed
US-20120134975-A1 Biological targeting compositions and methods of using the same SEARETE LLC, A LIMITED LIABILITY CORPORATION OF THE STATE OF DELAWARE 2012-05-31 US claimed
US-20100041133-A1 Biological targeting compositions and methods of using the same SEARETE LLC, A LIMITED LIABILITY CORPORATION OF THE STATE OF DELAWARE 2010-02-18 US claimed
US-20100041014-A1 Biological targeting compositions and methods of using the same ENTERPRISE SCIENCE FUND, LLC 2010-02-18 US claimed
EP-2379109-B1 COMBINATION OF PHOTODYNAMIC THERAPY AND ANTI-VEGF AGENTS IN THE TREATMENT OF UNWANTED CHOROIDAL NEOVASCULATURE BAUSCH HEALTH COMPANIES INC (CA) 2020-10-07 EP disclosed
EP-2294186-B1 INDUCING CELL DEATH BY INHIBITING ADAPTIVE HEAT SHOCK RESPONSE INCURON INC (US) 2019-10-09 EP disclosed
US-9226917-B2 Photodynamic therapy for conditions of the eye VALEANT PHARMACEUTICALS INTERNATIONAL, INC. (CA) 2016-01-05 US disclosed
US-8968715-B2 Drug delivery systems for photodynamic therapy THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2015-03-03 US disclosed
US-8852629-B2 Drug delivery system for hydrophobic drugs VALEANT PHARMACEUTICALS INTERNATIONAL, INC. (CA) 2014-10-07 US disclosed
US-8486697-B2 Inducing cell death by inhibiting adaptive heat shock response INCURON, LLC (US) 2013-07-16 US disclosed
EP-2600904-A1 ARTIFICIAL CELLS Searete LLC (US) 2013-06-12 EP disclosed
US-8211656-B2 Biological targeting compositions and methods of using the same THE INVENTION SCIENCE FUND I, LLC (US) 2012-07-03 US disclosed
WO-2002062386-A2 PHOTODYNAMIC THERAPY OF OCCULT CHOROIDAL NEOVASCULARIZATION LINKED TO AGE-RELATED MACULAR DEGENERATION QLT INC. (CA) 2002-08-15 WO disclosed
EP-1229937-A2 USE OF PDT TO INHIBIT INTIMAL HYPERPLASIA QLT Inc. (CA) 2002-08-14 EP disclosed
US-20020061330-A1 Supports for photosensitizer formulations BRITISH COLUMBIA, THE UNIVERSITY OF (CA) 2002-05-23 US disclosed
US-20020022032-A1 Immuno-adjuvant PDT treatment of metastatic tumors QLT INC. (CA) 2002-02-21 US disclosed
WO-2001085213-A2 SUPPORTS FOR PHOTOSENSITIZER FORMULATIONS THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2001-11-15 WO disclosed
WO-2001085212-A2 DRUG DELIVERY SYSTEMS FOR PHOTODYNAMIC THERAPY THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2001-11-15 WO disclosed
WO-2001035996-A2 USE OF PDT TO INHIBIT INTIMAL HYPERPLASIA QLT INC. (CA) 2001-05-25 WO disclosed
WO-2001035997-A2 USE OF LOW-DOSE PDT TO INHIBIT RESTENOSIS QLT INC. (CA) 2001-05-25 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 (2 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-20020061330-A1 Supports for photosensitizer formulations PPOX, PPIF, SDHA TDP1 1970/4885BLM 979/4885KDM4E 3097/4885
US-20020022032-A1 Immuno-adjuvant PDT treatment of metastatic tumors CD74, ANXA11, ANXA1 TDP1 3101/4885BLM 4110/4885KDM4E 4361/4885

“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.