SCHEMBL2664550

SCHEMBL2664550

O=C(Nc1ccc(-c2noc(=O)[nH]2)cn1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 1/20 0.52
DEGS1 O15121 1/20 0.51
RAB9A P51151 6/20 0.47
KMT2A Q03164 5/20 0.47
KDM4E B2RXH2 1/20 0.47
RARA P10276 1/20 0.47
NPC1 O15118 5/20 0.45
MAPT P10636 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MEN1 O00255 4/20 0.45
POLB P06746 1/20 0.44
AURKA O14965 1/20 0.44
AURKB Q96GD4 1/20 0.44
XDH P47989 1/20 0.44
SLC22A12 Q96S37 1/20 0.44

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
SCHEMBL23566420 0.77 DEGS1 (0.75) HCAR3DEGS1RAB9AKMT2AKDM4E
SCHEMBL2664555 0.75 HCAR3 (0.55) HCAR3DEGS1RAB9AKMT2AKDM4E
SCHEMBL20641476 0.73 RAB9A (0.66) HCAR3DEGS1RAB9AKMT2AKDM4E
SCHEMBL23437637 0.71 DEGS1 (0.74) HCAR3DEGS1RAB9AKMT2AKDM4E
SCHEMBL4443620 0.70 ALDH1A1 (0.57) XDHSLC22A12
SCHEMBL29220747 0.70 HCAR3 (0.71) HCAR3DEGS1RAB9AKMT2AKDM4E
SCHEMBL29519035 0.70 DEGS1 (0.82) HCAR3DEGS1RAB9AKMT2AKDM4E
SCHEMBL4909745 0.70 ALDH1A1 (0.53) KMT2AKDM4ERARAXDHSLC22A12
SCHEMBL13870148 0.70 DEGS1 (0.82) HCAR3DEGS1RAB9AKMT2AKDM4E
SCHEMBL2664544 0.70 HCAR3 (1.00) HCAR3DEGS1RAB9AKMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7951830-B2 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2011-05-31 US disclosed
US-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE ASTRAZENECA AB (SE) 2009-09-10 US disclosed
EP-1568367-B3 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2009-09-02 EP disclosed
US-7524957-B2 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2009-04-28 US disclosed
US-7524957-B2 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2009-04-28 US disclosed
US-20080207636-A1 Compounds Effecting Glucokinase ASTRAZENECA AB (SE) 2008-08-28 US disclosed
US-20080207636-A1 Compounds Effecting Glucokinase ASTRAZENECA AB (SE) 2008-08-28 US disclosed
US-7390908-B2 Such as 2-[3,5-Di(2-chlorobenzyloxy)benzoyl)amino]-thiazole; for treatment of diabetes ASTRAZENECA AB (SE) 2008-06-24 US disclosed
EP-1568367-B1 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2007-04-18 EP disclosed
EP-1568367-A1 Compounds effecting glucokinase AstraZeneca AB (SE) 2005-08-31 EP disclosed
EP-1529530-A1 Compounds affecting glucokinase AstraZeneca AB (SE) 2005-05-11 EP 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 (2 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-20080207636-A1 Compounds Effecting Glucokinase GCKR, GCK, SLC5A2 HCAR3 1545/4885DEGS1 951/4885RAB9A 3175/4885
US-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE GCKR, GCK, SLC5A2 HCAR3 1545/4885DEGS1 951/4885RAB9A 3175/4885

“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.