SCHEMBL1330239

SCHEMBL1330239

O=C(NC(=S)Nc1ncc(Br)cc1Oc1ccc(F)cc1)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.64
KCNH2 Q12809 1/20 0.64
EPHX1 P07099 3/20 0.49
SMN1; SMN2 Q16637 4/20 0.47
LMNA P02545 3/20 0.47
PKM P14618 2/20 0.47
MAPT P10636 1/20 0.47
RAB9A P51151 6/20 0.46
KIT P10721 1/20 0.46
PDGFRA P16234 1/20 0.46
ALDH1A1 P00352 4/20 0.46
ALOX12 P18054 2/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
HTT P42858 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
KDM4E B2RXH2 1/20 0.45
MET P08581 1/20 0.44
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43

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
SCHEMBL1327838 0.93 NPC1 (0.71) NPC1KCNH2EPHX1SMN1; SMN2LMNA
SCHEMBL1329388 0.87 NPC1 (0.61) NPC1KCNH2EPHX1SMN1; SMN2LMNA
SCHEMBL1328342 0.80 GCK (0.41) NPC1KCNH2PDGFRAALDH1A1ALOX12
SCHEMBL2340858 0.80 NPC1 (0.68) NPC1KCNH2EPHX1SMN1; SMN2LMNA
SCHEMBL14549276 0.80 NPC1 (0.55) NPC1KCNH2EPHX1SMN1; SMN2LMNA
SCHEMBL1329781 0.80 ALDH1A1 (0.56) NPC1KCNH2EPHX1SMN1; SMN2LMNA
SCHEMBL14471919 0.79 NPC1 (0.61) NPC1KCNH2EPHX1SMN1; SMN2LMNA
SCHEMBL2654831 0.79 KCNH2 (0.52) NPC1KCNH2EPHX1SMN1; SMN2LMNA
SCHEMBL2522214 0.79 NPC1 (1.00) NPC1KCNH2EPHX1SMN1; SMN2LMNA
SCHEMBL11165536 0.78 EPHX1 (0.60) NPC1EPHX1SMN1; SMN2LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2013204-B1 2-AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC (US) 2015-02-18 EP disclosed
EP-2543667-B1 A method of preparing 2-aminopyridine analogs as glucokinase activators ARRAY BIOPHARMA INC (US) 2015-01-28 EP disclosed
US-8883828-B2 2-aminopyridine analogs as glucokinase activators ARRAY BIOPHARMA INC. (US) 2014-11-11 US disclosed
EP-2543667-A9 2-aminopyridine analogs as glucokinase activators Array Biopharma, Inc. (US) 2013-08-21 EP disclosed
CN-101437816-B 2-aminopyridine analogs as glucokinase activators ARRAY BIOPHARMA INC 2013-08-14 CN disclosed
US-20130065901-A1 2-AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC. (US) 2013-03-14 US disclosed
US-8354540-B2 2-aminopyridine analogs as glucokinase activators ARRAY BIOPHARMA INC. (US) 2013-01-15 US disclosed
US-20110281874-A1 2-AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC. (US) 2011-11-17 US disclosed
US-8022223-B2 2-aminopyridine analogs as glucokinase activators ARRAY BIOPHARMA, INC. (US) 2011-09-20 US disclosed
US-20090156603-A1 2-AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC. (US) 2009-06-18 US disclosed
CN-101437816-A 2-aminopyridine analogs as glucokinase activators ARRAY BIOPHARMA INC (US) 2009-05-20 CN disclosed
EP-2013204-A2 2-AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS Array Biopharma, Inc. (US) 2009-01-14 EP disclosed
WO-2007117381-A9 2 -AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC (US) 2008-03-27 WO disclosed
WO-2007117381-A2 2 -AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC. (US) 2007-10-18 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 (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-20090156603-A1 2-AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS GCK, GCKR, PRKCSH NPC1 4280/4885KCNH2 472/4885EPHX1 4241/4885
US-20130065901-A1 2-AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS GCK, GCKR, GALK1 NPC1 3879/4885KCNH2 982/4885EPHX1 4374/4885
US-20110281874-A1 2-AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS GCK, GCKR, GALK1 NPC1 3879/4885KCNH2 982/4885EPHX1 4374/4885

“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.