SCHEMBL377762

SCHEMBL377762

CNc1nc(O)c2nc[nH]c2n1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.33
CCNB2 O95067 1/20 0.31
CDK1 P06493 1/20 0.31
CCNB1 P14635 1/20 0.31
CCNA2 P20248 1/20 0.31
CDK2 P24941 1/20 0.31
CCNA1 P78396 1/20 0.31
CCNB3 Q8WWL7 1/20 0.31
LMNA P02545 2/20 0.31
XDH P47989 1/20 0.31
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL10379702 0.84 GDA (0.34) PDPK1
SCHEMBL16147026 0.81 ADORA3 (0.37) CCNB2CDK1CCNB1CCNA2CDK2
SCHEMBL887124 0.80 CYP1A2 (0.40) LMNAPOLB
SCHEMBL11876693 0.79 XDH (0.39) PDPK1CCNB2CDK1CCNB1CCNA2
SCHEMBL16146172 0.78 HTT (0.38) CDK1LMNAXDHMEN1KMT2A
SCHEMBL9118 0.78 NOS1 (0.38) PDPK1CCNB2CDK1CCNB1CCNA2
SCHEMBL14110227 0.78 XDH (0.38) PDPK1CCNB2CDK1CCNB1CCNA2
SCHEMBL16146260 0.77 ESR1 (0.44) CDK2
SCHEMBL11334542 0.77 LMNA (0.33) PDPK1LMNAMEN1POLBKMT2A
Xanthine SCHEMBL918381 0.76 MEN1 (0.34) LMNAMEN1POLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140303112-A1 Method for treating disease or condition susceptible to amelioration by AMPK activators and compounds of formula which are useful to activate AMP-activated protein kinase (AMPK) ENERGENESIS BIOMEDICAL CO., LTD (TW) 2014-10-09 US claimed
CN-116492347-A Compound for activating AMPK and application thereof 华安医学股份有限公司 2023-07-28 CN disclosed
US-20200263231-A1 Fluorogenic dyes for high sensitivity DNA detection Life Technologies Corporation 2020-08-20 US disclosed
EP-2473563-B1 REACTIVE CYANINE COMPOUNDS PROMEGA CORP (US) 2019-06-19 EP disclosed
US-10139400-B2 Carboxy X rhodamine analogs PROMEGA CORPORATION (US) 2018-11-27 US disclosed
EP-2963033-B1 BENZIMIDAZOLE-4-CARBOXAMIDE DERIVATES, THEIR PREPARATION METHODS, PHARMACEUTICAL COMPOSITIONS AND THEIR USES UNIV SHANGHAI JIAOTONG (CN) 2018-08-01 EP disclosed
US-9938279-B2 Method for treating disease or condition susceptible to amelioration by AMPK activators and compounds of formula which are useful to activate AMP-activated protein kinase (AMPK) ENERGENESIS BIOMEDICAL CO., LTD (TW) 2018-04-10 US disclosed
EP-2782916-B1 CARBOXY X RHODAMINE ANALOGS PROMEGA CORP (US) 2018-02-28 EP disclosed
EP-2408863-B1 NUCLEIC ACID BINDING DYES AND USES THEREFOR PROMEGA CORP (US) 2018-01-10 EP disclosed
EP-2972229-B1 NEW SILICON AND GERMANIUM DYES FOR USE IN GENETIC IDENTITY PROMEGA CORP (US) 2017-12-27 EP disclosed
WO-2011026085-A2 REACTIVE CYANINE COMPOUNDS PROMEGA CORPORATION (US) 2011-03-03 WO disclosed
WO-2010107816-A2 NUCLEIC ACID BINDING DYES AND USES THEREFOR PROMEGA CORPORATION (US) 2010-09-23 WO disclosed
US-20100233710-A1 NUCLEIC ACID BINDING DYES AND USES THEREFOR JPMORGAN CHASE BANK, N.A., AS COLLATERAL AGENT 2010-09-16 US disclosed
EP-0740689-B1 SUBSTITUTED UNSYMMETRICAL CYANINE DYES WITH SELECTED PERMEABILITY MOLECULAR PROBES INC (US) 2002-01-30 EP disclosed
US-5733539-A PLANT FERMENTED MATRIX MATERIAL CONTAINIGN AMINO ACID RESEARCH INSTITUTE FOR PRODUCTION DEVELOPMENT (JP) 1998-03-31 US disclosed
US-5719031-A MEASURING FLUORESCENCE MOLECULAR PROBES, INC. (US) 1998-02-17 US disclosed
EP-0796564-A1 FEED FOR FISHES AND SHELLFISHES RESEARCH INSTITUTE FOR PRODUCTION DEVELOPMENT (JP) 1997-09-24 EP disclosed
US-5658751-A SUBSTITUENTS ON PYRIDINIUM OR QUINOLINIUM RING SYSTEM SERVE TO INCREASE OR DECREASE PERMEABILITY, SELECTIVITY AND BINDING AFFINITY OF NUCLEIC ACID STAINS; FORM FLUORESCENT COMPLEXES WITH NUCLEIC ACIDS MOLECULAR PROBES, INC. (US) 1997-08-19 US disclosed
US-5656449-A STAINING NUCLEIC ACIDS MOLECULAR PROBES, INC. (US) 1997-08-12 US disclosed
WO-1996013552-A2 SUBSTITUTED UNSYMMETRICAL CYANINE DYES WITH SELECTED PERMEABILITY MOLECULAR PROBES, INC. (US) 1996-05-09 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 (4 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-20140303112-A1 Method for treating disease or condition susceptible to amelioration by AMPK activators and compounds of formula which are useful to activate AMP-activated protein kinase (AMPK) PRKAG2, PRKAB2, PRKAG1 PDPK1 281/4885CCNB2 3940/4885CDK1 2235/4885
US-20100233710-A1 NUCLEIC ACID BINDING DYES AND USES THEREFOR POLRMT, POLB, POLL PDPK1 4385/4885CCNB2 1117/4885CDK1 1973/4885
US-10139400-B2 Carboxy X rhodamine analogs PRCP, CPA3, CPA4 PDPK1 4776/4885CCNB2 3391/4885CDK1 3140/4885
US-20200263231-A1 Fluorogenic dyes for high sensitivity DNA detection POLRMT, POLM, DNMT3A PDPK1 3905/4885CCNB2 748/4885CDK1 2228/4885

“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.