SCHEMBL2661045

SCHEMBL2661045

Cn1cc(Oc2cc(Br)cnc2C#N)cn1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 14/20 0.37
CYP11B1 P15538 2/20 0.37
CYP11B2 P19099 1/20 0.37
TYRO3 Q06418 1/20 0.32
KCNH2 Q12809 2/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNA4 P43681 1/20 0.31
SCN9A Q15858 1/20 0.31
PIK3CD O00329 1/20 0.31
CHEK2 O96017 1/20 0.31
LCK P06239 1/20 0.31
LYN P07948 1/20 0.31
PIM1 P11309 1/20 0.31
RPS6KB1 P23443 1/20 0.31
FLT3 P36888 1/20 0.31
BLK P51451 1/20 0.31
PRKAG1 P54619 1/20 0.31
PRKAA1 Q13131 1/20 0.31
PIM3 Q86V86 1/20 0.31
PRKAB1 Q9Y478 1/20 0.31

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
SCHEMBL3593503 0.77 BRD4 (0.34) CYP11B1CYP11B2
SCHEMBL1329646 0.73 SLC22A12 (0.40) CYP11B1CYP11B2
SCHEMBL1629163 0.73 USP8 (0.38) CHEK1
SCHEMBL2659607 0.71 AR (0.32)
SCHEMBL15402990 0.71 CYP11B1 (0.43) CYP11B1CYP11B2
SCHEMBL16650785 0.70 KDM4C (0.36)
SCHEMBL20944147 0.70 GRM5 (0.42) CHEK1
SCHEMBL2656038 0.69 GCK (0.38) CYP11B2
SCHEMBL21291534 0.69 GPR119 (0.33)
SCHEMBL2656539 0.68 GCK (0.31)

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-8362037-B2 2-aminopyridine analogs as glucokinase activators ARRAY BIOPHARMA, INC. (US) 2013-01-29 US disclosed
US-20100105659-A1 2-AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS ARRAY BIOPPHARMA INC. (US) 2010-04-29 US disclosed
EP-2173745-A2 2-AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS Array Biopharma, Inc. (US) 2010-04-14 EP disclosed
WO-2008118718-A2 2-AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC. (US) 2008-10-02 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 (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-20100105659-A1 2-AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS GCK, GCKR, GALK1 CHEK1 2937/4885CYP11B1 3195/4885CYP11B2 2688/4885

“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.