SCHEMBL2649575

SCHEMBL2649575

Cc1cc(COCc2cc(OCc3ccccc3F)cc(C(=O)O)c2)no1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCK P35557 2/20 0.46
RARA P10276 1/20 0.46
RARB P10826 1/20 0.46
RARG P13631 1/20 0.46
LPAR1 Q92633 3/20 0.42
LPAR5 Q9H1C0 3/20 0.42
MAOB P27338 2/20 0.42
ALKBH1 Q13686 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
KDM5A P29375 1/20 0.41
KDM5B Q9UGL1 1/20 0.41
PARP15 Q460N3 1/20 0.40
PARP14 Q460N5 1/20 0.40
PARP10 Q53GL7 1/20 0.40
HPD P32754 1/20 0.40
MRGPRX4 Q96LA9 1/20 0.39
KCNH2 Q12809 4/20 0.38
SCN3A Q9NY46 4/20 0.38
SCN1A P35498 1/20 0.38

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
SCHEMBL2651135 0.91 MAOB (0.41) GCKRARARARBRARGMAOB
SCHEMBL5419201 0.88 GCK (0.68) GCKRARARARBRARG
SCHEMBL5421905 0.82 GCK (0.58) GCKRARARARBRARG
SCHEMBL2666464 0.79 GCK (0.38) GCKRARARARBRARGLPAR1
SCHEMBL2649577 0.78 PARP15 (0.44) GCKRARARARBRARGMAOB
SCHEMBL14505832 0.77 MAOB (0.54) GCKRARARARBRARGLPAR1
SCHEMBL14505833 0.77 GCK (0.56) GCKRARARARBRARGLPAR1
SCHEMBL1654034 0.76 GCK (0.66) GCKRARARARBRARGLPAR1
SCHEMBL711300 0.73 GCK (0.59) GCKRARARARBRARGLPAR1
SCHEMBL14505809 0.72 GCK (0.68) GCKRARARARBRARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070112040-A1 Amino nicotinate derivatives as glucokinase (GLK) modulators ASTRAZENECA AB 2007-05-17 US disclosed
US-20070112040-A1 Amino nicotinate derivatives as glucokinase (GLK) modulators ASTRAZENECA AB 2007-05-17 US disclosed
US-20070112040-A1 Amino nicotinate derivatives as glucokinase (GLK) modulators ASTRAZENECA AB 2007-05-17 US disclosed
US-20040214868-A1 Amino nicotinate derivatives as glucokinase (GLK) modulators ASTRAZENECA AB (SE) 2004-10-28 US disclosed
EP-1404335-A1 AMINO NICOTINATE DERIVATIVES AS GLUCOKINASE (GLK) MODULATORS Astrazeneca AB (SE) 2004-04-07 EP disclosed
WO-2003000267-A1 AMINO NICOTINATE DERIVATIVES AS GLUCOKINASE (GLK) MODULATORS ASTRAZENECA AB (SE) 2003-01-03 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-20070112040-A1 Amino nicotinate derivatives as glucokinase (GLK) modulators GCK, GCKR, NADK GCK 1/4885RARA 3103/4885RARB 3070/4885
US-20040214868-A1 Amino nicotinate derivatives as glucokinase (GLK) modulators GCK, GCKR, NADK GCK 1/4885RARA 2675/4885RARB 2807/4885

“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.