SCHEMBL18015698

SCHEMBL18015698

O=C(N[C@H]1CC[C@@H](Oc2cc(F)cc(F)c2)CC1)c1ccc(C(=O)N2CCC(C(=O)c3ccc(F)cc3)CC2)cn1

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PRKAA2 P54646 20/20 0.71
PRKAB2 O43741 14/20 0.61
PRKAG1 P54619 14/20 0.61
PRKAA1 Q13131 14/20 0.61
PRKAG3 Q9UGI9 14/20 0.61
PRKAG2 Q9UGJ0 14/20 0.61
PRKAB1 Q9Y478 14/20 0.61
CYP3A4 P08684 1/20 0.53

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
SCHEMBL18013671 1.00 PRKAA2 (0.71) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL518530 0.94 PRKAA2 (0.79) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL518531 0.94 PRKAA2 (0.79) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL518961 0.93 PRKAA2 (0.64) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL518960 0.93 PRKAA2 (0.64) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL518958 0.92 PRKAA2 (0.79) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL518959 0.92 PRKAA2 (0.79) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL518684 0.90 PRKAA2 (0.73) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL518685 0.90 PRKAA2 (0.73) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL15164567 0.88 PRKAA2 (0.91) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9663496-B2 AMPK-activating heterocyclic compounds and methods for using the same RIGEL PHARMACEUTICALS, INC. (US) 2017-05-30 US disclosed
US-20160229838-A1 AMPK-ACTIVATING HETEROCYCLIC COMPOUNDS AND METHODS FOR USING THE SAME MIDCAP FINANCIAL TRUST 2016-08-11 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-20160229838-A1 AMPK-ACTIVATING HETEROCYCLIC COMPOUNDS AND METHODS FOR USING THE SAME PRKAG1, PRKAG2, PRKAB1 PRKAA2 7/4885PRKAB2 5/4885PRKAG1 1/4885

“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.