SCHEMBL4340352

SCHEMBL4340352

COC(=O)c1ccc(C(=O)NC2CCN(Cc3ccc(C#N)cc3)CC2)cc1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRKAA2 P54646 16/20 0.64
PRKAB2 O43741 12/20 0.61
PRKAG1 P54619 12/20 0.61
PRKAA1 Q13131 12/20 0.61
PRKAG3 Q9UGI9 12/20 0.61
PRKAG2 Q9UGJ0 12/20 0.61
PRKAB1 Q9Y478 12/20 0.61
KCNH2 Q12809 1/20 0.59
CYP3A4 P08684 2/20 0.56
MCHR1 Q99705 1/20 0.56
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55

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
SCHEMBL16938688 0.90 PRKAA2 (0.57) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL14649115 0.89 PRKAA2 (0.66) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL13245079 0.88 PRKAA2 (0.78) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL2508098 0.88 TMEM97 (0.71) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL4341273 0.88 PRKAA2 (0.67) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL63417 0.87 PRKAA2 (0.69) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL15745866 0.86 MEN1 (0.60) KCNH2CYP3A4MCHR1MEN1KMT2A
SCHEMBL1077166 0.85 DRD4 (0.68) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL1035332 0.83 PRKAA2 (0.69) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL12265140 0.83 PRKAA2 (0.65) 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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9353111-B2 Carboxamide compounds and methods for using the same RIGEL PHARMACEUTICALS, INC. (US) 2016-05-31 US disclosed
US-9353111-B2 Carboxamide compounds and methods for using the same RIGEL PHARMACEUTICALS, INC. (US) 2016-05-31 US disclosed
US-20160122321-A1 Carboxamide Compounds and Methods for Using the Same MIDCAP FINANCIAL TRUST 2016-05-05 US disclosed
US-20160122321-A1 Carboxamide Compounds and Methods for Using the Same MIDCAP FINANCIAL TRUST 2016-05-05 US disclosed
US-9255085-B2 Carboxamide compounds and methods for using the same RIGEL PHARMACEUTICALS, INC. (US) 2016-02-09 US disclosed
US-20150232451-A1 Carboxamide Compounds and Methods for Using the Same MIDCAP FINANCIAL TRUST 2015-08-20 US disclosed
US-20150232451-A1 Carboxamide Compounds and Methods for Using the Same MIDCAP FINANCIAL TRUST 2015-08-20 US disclosed
US-9062052-B2 Carboxamide compounds and methods for using the same RIGEL PHARMACEUTICALS, INC. (US) 2015-06-23 US disclosed
US-9062052-B2 Carboxamide compounds and methods for using the same RIGEL PHARMACEUTICALS, INC. (US) 2015-06-23 US disclosed
US-20150011582-A1 Carboxamide Compounds and Methods for Using the Same MIDCAP FINANCIAL TRUST 2015-01-08 US disclosed
US-20130023660-A1 Carboxamide Compounds and Methods for Using the Same RIGEL PHARMACEUTICALS, INC. (US) 2013-01-24 US disclosed
US-8314107-B2 Carboxamide compounds and methods for using the same RIGEL PHARMACEUTICALS, INC. (US) 2012-11-20 US disclosed
US-8314107-B2 Carboxamide compounds and methods for using the same RIGEL PHARMACEUTICALS, INC. (US) 2012-11-20 US disclosed
US-8314107-B2 Carboxamide compounds and methods for using the same RIGEL PHARMACEUTICALS, INC. (US) 2012-11-20 US disclosed
US-20100190802-A1 CARBOXAMIDE COMPOUNDS AND METHODS FOR USING THE SAME RIGEL PHARMACEUTICALS INC. (US) 2010-07-29 US disclosed
US-20100190802-A1 CARBOXAMIDE COMPOUNDS AND METHODS FOR USING THE SAME RIGEL PHARMACEUTICALS INC. (US) 2010-07-29 US disclosed
US-20090275609-A1 Carboxamide Compounds and Methods for Using The Same RIGEL PHARMACEUTICALS, INC. (US) 2009-11-05 US disclosed
US-20090275609-A1 Carboxamide Compounds and Methods for Using The Same RIGEL PHARMACEUTICALS, INC. (US) 2009-11-05 US disclosed
US-20090275609-A1 Carboxamide Compounds and Methods for Using The Same RIGEL PHARMACEUTICALS, INC. (US) 2009-11-05 US disclosed
WO-2009132136-A1 CARBOXAMIDE COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS RIGEL PHARMACEUTICALS, INC. (US) 2009-10-29 WO 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 (6 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-20160122321-A1 Carboxamide Compounds and Methods for Using the Same PC, AK2, PRKAA2 PRKAA2 3/4885PRKAB2 8/4885PRKAG1 6/4885
US-20130023660-A1 Carboxamide Compounds and Methods for Using the Same PC, AK2, PRKAA2 PRKAA2 3/4885PRKAB2 8/4885PRKAG1 6/4885
US-20150232451-A1 Carboxamide Compounds and Methods for Using the Same PC, AK2, PRKAA2 PRKAA2 3/4885PRKAB2 8/4885PRKAG1 6/4885
US-20090275609-A1 Carboxamide Compounds and Methods for Using The Same PC, AK2, PRKAA2 PRKAA2 3/4885PRKAB2 8/4885PRKAG1 6/4885
US-20150011582-A1 Carboxamide Compounds and Methods for Using the Same PC, AK2, PRKAA2 PRKAA2 3/4885PRKAB2 8/4885PRKAG1 6/4885
US-20100190802-A1 CARBOXAMIDE COMPOUNDS AND METHODS FOR USING THE SAME PC, AK2, PRKAA1 PRKAA2 4/4885PRKAB2 9/4885PRKAG1 6/4885

“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.