SCHEMBL643526

SCHEMBL643526

Cc1nc(COc2cc(C(=O)Nc3ccn(C)n3)cc3c2CC(C)(C)O3)no1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GCK P35557 9/20 0.55
GABRA5 P31644 1/20 0.41
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
IRAK4 Q9NWZ3 2/20 0.38
HPGDS O60760 1/20 0.38
GRM5 P41594 1/20 0.35
NOTUM Q6P988 1/20 0.35
RPS6KA3 P51812 1/20 0.34
RPS6KA2 Q15349 1/20 0.34

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
SCHEMBL642378 0.90 GCK (0.53) GCKGABRA5NPC1RAB9AIRAK4
SCHEMBL642428 0.87 GCK (0.55) GCKGABRA5NPC1RAB9AIRAK4
SCHEMBL644857 0.86 GCK (0.52) GCKGABRA5NPC1RAB9AIRAK4
SCHEMBL644899 0.84 GCK (0.62) GCKNPC1RAB9AIRAK4HPGDS
SCHEMBL642856 0.84 GCK (0.58) GCKGABRA5NPC1RAB9AIRAK4
SCHEMBL642861 0.83 GCK (0.54) GCKGABRA5NPC1RAB9AIRAK4
SCHEMBL643716 0.82 GCK (0.55) GCKGABRA5NPC1RAB9AIRAK4
SCHEMBL643106 0.82 GCK (0.53) GCKGABRA5NPC1RAB9AIRAK4
SCHEMBL2645105 0.81 SMPD1 (0.35) GCKIRAK4
SCHEMBL643951 0.81 GCK (0.59) GCKNPC1RAB9AIRAK4HPGDS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2010520-B1 HETEROBICYCLIC AMIDES FOR THE PREVENTION AND TREATMENT OF GLUCOKINASE-MEDIATED DISEASES PFIZER PROD INC (US) 2012-09-12 EP disclosed
EP-2463283-A1 Fused phenyl Amido heterocyclic compounds for the prevention and treatment of glucokinase-mediated diseases Pfizer Products Inc. (US) 2012-06-13 EP disclosed
US-8119624-B2 Fused phenyl amido heterocyclic compounds PFIZER INC. (US) 2012-02-21 US disclosed
US-8119624-B2 Fused phenyl amido heterocyclic compounds PFIZER INC. (US) 2012-02-21 US disclosed
US-8119624-B2 Fused phenyl amido heterocyclic compounds PFIZER INC. (US) 2012-02-21 US disclosed
US-20110039821-A1 Fused Phenyl Amido Heterocyclic Compounds PFIZER INC 2011-02-17 US disclosed
US-20110039821-A1 Fused Phenyl Amido Heterocyclic Compounds PFIZER INC 2011-02-17 US disclosed
US-20110039821-A1 Fused Phenyl Amido Heterocyclic Compounds PFIZER INC 2011-02-17 US disclosed
US-7842713-B2 Fused phenyl amido heterocyclic compounds PFIZER INC (US) 2010-11-30 US disclosed
US-7842713-B2 Fused phenyl amido heterocyclic compounds PFIZER INC (US) 2010-11-30 US disclosed
US-20080280875-A1 FUSED PHENYL AMIDO HETEROCYCLIC COMPOUNDS PFIZER INC. 2008-11-13 US disclosed
US-20080280875-A1 FUSED PHENYL AMIDO HETEROCYCLIC COMPOUNDS PFIZER INC. 2008-11-13 US disclosed
WO-2007122482-A1 FUSED PHENYL AMIDO HETEROCYCLIC COMPOUNDS FOR THE PREVENTION AND TREATMENT OF GLUCOKINASE-MEDIATED DISEASES PFIZER PRODUCTS INC. (US) 2007-11-01 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 (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-20110039821-A1 Fused Phenyl Amido Heterocyclic Compounds GCK, GCKR, HK1 GCK 1/4885GABRA5 3564/4885NPC1 1969/4885
US-20080280875-A1 FUSED PHENYL AMIDO HETEROCYCLIC COMPOUNDS GCK, GCKR, HK1 GCK 1/4885GABRA5 3564/4885NPC1 1969/4885

“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.