SCHEMBL644253

SCHEMBL644253

COCc1cc2c(Oc3ccc(S(C)(=O)=O)cc3)cc(C(=O)Nc3cc(C)on3)cc2o1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GCK P35557 10/20 0.61
KCNH2 Q12809 3/20 0.61
SMN1; SMN2 Q16637 4/20 0.45
NPC1 O15118 4/20 0.45
RAB9A P51151 4/20 0.45
TP53 P04637 2/20 0.45
ALDH1A1 P00352 2/20 0.43
HTT P42858 1/20 0.43
GAA P10253 3/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
PAX8 Q06710 1/20 0.42
KMT2A Q03164 1/20 0.41

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
SCHEMBL10287463 0.89 GCK (0.49) GCKKCNH2SMN1; SMN2NPC1RAB9A
SCHEMBL644618 0.89 GCK (0.75) GCKKCNH2SMN1; SMN2NPC1RAB9A
SCHEMBL646143 0.87 GCK (0.63) GCKKCNH2NPC1RAB9ATP53
SCHEMBL644893 0.85 GCK (0.57) GCKKCNH2
SCHEMBL642530 0.85 GCK (0.55) GCKKCNH2
SCHEMBL2663680 0.85 GCK (0.46) GCKKCNH2SMN1; SMN2NPC1RAB9A
SCHEMBL644759 0.85 GCK (0.57) GCKKCNH2
SCHEMBL642857 0.84 GCK (0.65) GCKKCNH2
SCHEMBL646516 0.84 GCK (0.64) GCKKCNH2
SCHEMBL643936 0.82 GCK (0.48) GCKKCNH2SMN1; SMN2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2463283-B1 Fused phenyl Amido heterocyclic compounds for the prevention and treatment of glucokinase-mediated diseases PFIZER PROD INC (US) 2014-06-11 EP disclosed
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-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

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 1/4885KCNH2 307/4885SMN1; SMN2 2653/4885
US-20080280875-A1 FUSED PHENYL AMIDO HETEROCYCLIC COMPOUNDS GCK, GCKR, HK1 GCK 1/4885KCNH2 307/4885SMN1; SMN2 2653/4885

“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.