SCHEMBL16146643

SCHEMBL16146643

CC(=O)Nc1nc(N)nc2nc[nH]c12

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MGMT P16455 2/20 0.55
GDA Q9Y2T3 2/20 0.54
DPP4 P27487 1/20 0.53
BRAF P15056 9/20 0.52
HDAC1 Q13547 2/20 0.52
HDAC2 Q92769 2/20 0.52
PDPK1 O15530 1/20 0.51
CDK1 P06493 1/20 0.50
MAP3K5 Q99683 1/20 0.49
CDK2 P24941 1/20 0.49
NUDT1 P36639 1/20 0.48

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
SCHEMBL16146679 0.83 GDA (0.55) MGMTGDABRAF
SCHEMBL31506448 0.83 GDA (0.55) GDABRAF
SCHEMBL16146528 0.83 GDA (0.55) MGMTGDABRAF
SCHEMBL750335 0.83 GDA (0.55) GDABRAF
SCHEMBL5694222 0.83 GDA (0.55) MGMTGDABRAF
SCHEMBL16146215 0.82 GDA (0.54) MGMTGDABRAFHDAC1CDK2
SCHEMBL16146725 0.82 GDA (0.54) MGMTGDABRAFHDAC1HDAC2
SCHEMBL16145715 0.82 GDA (0.54) MGMTGDABRAF
SCHEMBL5694220 0.82 XDH (0.65) GDABRAF
SCHEMBL16145843 0.81 GDA (0.52) MGMTGDABRAF

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
CN-104447746-A Compound for activating AMPK and application thereof HUAAN MEDICAL CO LTD 2015-03-25 CN claimed
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
CN-115052986-A Compositions comprising nucleases and uses thereof 阿伯生物技术公司 2022-09-13 CN disclosed
CN-113661242-A Compositions comprising modified cyclic polyribonucleotides and uses thereof 旗舰创业创新第六有限责任公司 2021-11-16 CN disclosed
CN-113543770-A Compositions, methods and kits for delivery of polyribonucleotides 旗舰创业创新第六有限责任公司 2021-10-22 CN disclosed
CN-113543766-A Polyribonucleotides and their cosmetic use 旗舰创业创新第六有限责任公司 2021-10-22 CN disclosed
CN-113453707-A RNA for malaria vaccine 库瑞瓦格股份公司 2021-09-28 CN disclosed
CN-111819185-A Compositions comprising cyclic polyribonucleotides and uses thereof 旗舰创业创新第六有限责任公司 2020-10-23 CN 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-1525209-B1 1'-, 2'- AND 3' -MODIFIED NUCLEOSIDE DERIVATIVES FOR TREATING FLAVIVIRIDAE INFECTIONS IDENIX PHARMACEUTICALS LLC (US) 2017-11-15 EP disclosed
CN-104447746-A Compound for activating AMPK and application thereof HUAAN MEDICAL CO LTD 2015-03-25 CN disclosed
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 disclosed
US-7662798-B2 2′ and 3′-nucleoside prodrugs for treating Flaviviridae infections IDENIX PHARMACEUTICALS, INC. (US) 2010-02-16 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 (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-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 MGMT 3321/4885GDA 1170/4885DPP4 624/4885

“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.