SCHEMBL19917501

SCHEMBL19917501

COc1ccc(C(=O)C2CCN(C(=O)c3ccc(C(=O)NC4CCN(Cc5ccc(C#N)c(F)c5)CC4)cn3)CC2)cc1

nearest known ligand 0.79

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PRKAB2 O43741 10/20 0.79
PRKAG1 P54619 10/20 0.79
PRKAA2 P54646 10/20 0.79
PRKAA1 Q13131 10/20 0.79
PRKAG3 Q9UGI9 10/20 0.79
PRKAG2 Q9UGJ0 10/20 0.79
PRKAB1 Q9Y478 10/20 0.79
KCNH2 Q12809 1/20 0.79
CYP3A4 P08684 2/20 0.65

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
SCHEMBL519050 0.90 CYP3A4 (0.70) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL10269264 0.90 CYP3A4 (0.70) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL519049 0.90 CYP3A4 (0.70) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL519051 0.90 CYP3A4 (0.70) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL15171706 0.90 CYP3A4 (0.80) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL15171873 0.89 PRKAB2 (0.63) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL518517 0.89 PRKAA2 (1.00) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL518428 0.89 PRKAA2 (0.79) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL517986 0.88 PRKAB2 (1.00) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL517920 0.88 PRKAA2 (1.00) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10941134-B2 AMPK-activating heterocyclic compounds and methods for using the same RIGEL PHARMACEUTICALS, INC. (US) 2021-03-09 US disclosed
US-10377742-B2 AMPK-activating heterocyclic compounds and methods for using the same RIGEL PHARMACEUTICALS, INC. (US) 2019-08-13 US disclosed
US-20180057478-A1 AMPK-ACTIVATING HETEROCYCLIC COMPOUNDS AND METHODS FOR USING THE SAME RIGEL PHARMACEUTICALS, INC. (US) 2018-03-01 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 (3 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-20180057478-A1 AMPK-ACTIVATING HETEROCYCLIC COMPOUNDS AND METHODS FOR USING THE SAME PRKAG1, PRKAG2, PRKAB1 PRKAB2 5/4885PRKAG1 1/4885PRKAA2 7/4885
US-10941134-B2 AMPK-activating heterocyclic compounds and methods for using the same PRKAG1, PRKAG2, PRKAB1 PRKAB2 5/4885PRKAG1 1/4885PRKAA2 7/4885
US-10377742-B2 AMPK-activating heterocyclic compounds and methods for using the same PRKAG1, PRKAG2, PRKAB1 PRKAB2 5/4885PRKAG1 1/4885PRKAA2 7/4885

“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.