SCHEMBL16147152

SCHEMBL16147152

Nc1nc(NCc2ccc(O)cc2)nc2[nH]cnc12

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 9/20 0.41
ADORA1 P30542 6/20 0.40
ADORA3 P0DMS8 4/20 0.40
ADORA2B P29275 4/20 0.40
CCNB2 O95067 1/20 0.39
CDK1 P06493 1/20 0.39
CCNB1 P14635 1/20 0.39
CCNB3 Q8WWL7 1/20 0.39
APP P05067 4/20 0.38
TMIGD3 P0DMS9 1/20 0.38
CSNK1D P48730 1/20 0.37
CA9 Q16790 1/20 0.37
STAT6 P42226 1/20 0.37
MAPT P10636 1/20 0.36

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
SCHEMBL16146639 0.86 KCNH3 (0.46) ADORA2AADORA1ADORA3ADORA2BAPP
SCHEMBL16147175 0.86 APP (0.52) ADORA2AAPP
SCHEMBL16146759 0.86 APP (0.52) ADORA2AADORA1ADORA3ADORA2BAPP
SCHEMBL16145712 0.86 CDK1 (0.40) CCNB2CDK1CCNB1CCNB3CA9
SCHEMBL13729103 0.86 APP (0.54) ADORA2AADORA1ADORA3ADORA2BCDK1
SCHEMBL16147158 0.85 ALPL (0.51) ADORA2AADORA1ADORA3ADORA2BCSNK1D
SCHEMBL16147003 0.82 LMNA (0.36) ADORA2AADORA1ADORA3ADORA2B
SCHEMBL16147154 0.80 MAPT (0.52) ADORA3CDK1MAPT
SCHEMBL10047091 0.77 CDK1 (0.33) ADORA2AADORA1ADORA3ADORA2BCDK1
SCHEMBL30605171 0.77 CDK1 (0.55) CCNB2CDK1CCNB1CCNB3

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 4 patents. 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-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
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

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 ADORA2A 511/4885ADORA1 1262/4885ADORA3 1280/4885

“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.