SCHEMBL2407065

SCHEMBL2407065

N#Cc1ccc(CN2CCC(Oc3ccccc3C(=O)NC3CCNCC3)CC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRKAA2 P54646 10/20 0.56
UTS2R Q9UKP6 6/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
PRKAB2 O43741 6/20 0.52
PRKAG1 P54619 6/20 0.52
PRKAA1 Q13131 6/20 0.52
PRKAG3 Q9UGI9 6/20 0.52
PRKAG2 Q9UGJ0 6/20 0.52
PRKAB1 Q9Y478 6/20 0.52
CYP3A4 P08684 1/20 0.52
HRH3 Q9Y5N1 1/20 0.52
SLC6A12 P48065 1/20 0.49

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
SCHEMBL2391086 0.83 PRKAA2 (0.69) PRKAA2UTS2RPRKAB2PRKAG1PRKAA1
Hydrochloric Acid SCHEMBL2391748 0.82 PRKAA2 (0.68) PRKAA2UTS2RPRKAB2PRKAG1PRKAA1
SCHEMBL2389715 0.78 SLC6A12 (0.62) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL2390761 0.78 UTS2R (0.65) PRKAA2UTS2RMEN1KMT2APRKAB2
SCHEMBL2391731 0.77 PRKAA2 (0.68) PRKAA2UTS2RMEN1KMT2APRKAB2
SCHEMBL15817333 0.77 PRKAA2 (0.65) PRKAA2UTS2RPRKAB2PRKAG1PRKAA1
SCHEMBL12264881 0.76 HRH3 (0.60) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL15171508 0.76 PRKAA2 (0.65) PRKAA2KMT2APRKAB2PRKAG1PRKAA1
SCHEMBL2390055 0.76 MCHR1 (0.59) PRKAA2UTS2RMEN1KMT2APRKAB2
SCHEMBL2389604 0.76 KMT2A (0.65) PRKAA2KMT2APRKAB2PRKAG1PRKAA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9181220-B2 N-substituted-heterocycloalkyloxybenzamide compounds and methods of use RIGEL PHARMACEUTICALS, INC. (US) 2015-11-10 US disclosed
US-20140179738-A1 N-Substituted-Heterocycloalkyloxybenzamide Compounds and Methods of Use RIGEL PHARMACEUTICALS, INC. (US) 2014-06-26 US disclosed
US-8697727-B2 N-substituted-heterocycloalkyloxybenzamide compounds and methods of use RIGEL PHARMACEUTICALS, INC. (US) 2014-04-15 US disclosed
US-20110306767-A1 N-Substituted-Heterocycloalkyloxybenzamide Compounds and Methods of Use RIGEL PHARMACEUTICALS, INC. (US) 2011-12-15 US disclosed
US-8012955-B2 N-substituted-heterocycloalkyloxybenzamide compounds and methods of use RIGEL PHARMACEUTICALS, INC. (US) 2011-09-06 US disclosed
US-20090186894-A1 N-Substituted-Heterocycloalkyloxybenzamide Compounds and Methods of Use RIGEL PHARMACEUTICALS, INC. (US) 2009-07-23 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-20110306767-A1 N-Substituted-Heterocycloalkyloxybenzamide Compounds and Methods of Use PRKAG2, PRKAB2, PRKAG1 PRKAA2 7/4885UTS2R 1914/4885MEN1 3006/4885
US-20140179738-A1 N-Substituted-Heterocycloalkyloxybenzamide Compounds and Methods of Use PRKAG2, PRKAB2, PRKAG1 PRKAA2 7/4885UTS2R 1914/4885MEN1 3006/4885
US-20090186894-A1 N-Substituted-Heterocycloalkyloxybenzamide Compounds and Methods of Use PRKAG2, PRKAB2, PRKAG1 PRKAA2 7/4885UTS2R 1914/4885MEN1 3006/4885

“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.