SCHEMBL2664774

SCHEMBL2664774

O=C(Nc1ncc(C(=O)O)s1)c1cc(OCC2CC2)cc(OCC2CC2)c1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GCK P35557 2/20 0.48
NR1H4 Q96RI1 3/20 0.47
CNR2 P34972 1/20 0.44
P2RX3 P56373 6/20 0.43
P2RX2 Q9UBL9 6/20 0.43
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
SCD O00767 1/20 0.41
ACACB O00763 1/20 0.41
KAT6A Q92794 1/20 0.41
GPR35 Q9HC97 1/20 0.40
FABP1 P07148 1/20 0.40

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
SCHEMBL2664752 0.92 GCK (0.61) GCKNR1H4P2RX3P2RX2ACACB
SCHEMBL2664758 0.88 GCK (0.67) GCKCNR2
SCHEMBL2664716 0.80 GCK (0.54) GCKNR1H4SCD
SCHEMBL2664690 0.79 GCK (0.61) GCKNR1H4NPC1RAB9ASMN1; SMN2
SCHEMBL2664723 0.77 GCK (0.51) GCK
SCHEMBL2664707 0.77 GCK (0.45) GCKNR1H4CNR2
SCHEMBL2664722 0.76 GCK (0.63) GCKNR1H4
SCHEMBL2664761 0.75 GCK (0.50) GCK
SCHEMBL2664759 0.75 GCK (0.52) GCK
SCHEMBL1796180 0.75 CSNK2A2 (0.55) GCKNPC1RAB9ASCD

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 10 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-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
US-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE ASTRAZENECA AB (SE) 2009-09-10 US 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
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

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 GCK 2/4885NR1H4 3923/4885CNR2 963/4885
US-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE GCKR, GCK, SLC5A2 GCK 2/4885NR1H4 3923/4885CNR2 963/4885

“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.