SCHEMBL320929

SCHEMBL320929

COC[C@H](C)Oc1cc(Oc2cnc(C(=O)N3CCC3)cn2)cc(C(=O)OC)c1

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GCK P35557 20/20 0.75
KCNH2 Q12809 5/20 0.58
CYP1A2 P05177 1/20 0.51
ABCB1 P08183 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2C8 P10632 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2B6 P20813 1/20 0.51
CYP2C19 P33261 1/20 0.51

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
SCHEMBL1427642 1.00 GCK (0.75) GCKKCNH2CYP1A2ABCB1CYP3A4
SCHEMBL2662756 0.92 GCK (0.73) GCKKCNH2CYP1A2ABCB1CYP3A4
SCHEMBL1426943 0.92 GCK (0.73) GCKKCNH2CYP1A2ABCB1CYP3A4
SCHEMBL2667114 0.92 GCK (0.63) GCKKCNH2CYP1A2ABCB1CYP3A4
SCHEMBL1140709 0.92 GCK (0.73) GCKKCNH2CYP1A2ABCB1CYP3A4
SCHEMBL320649 0.92 GCK (0.73) GCKKCNH2CYP1A2ABCB1CYP3A4
SCHEMBL1427151 0.91 GCK (0.64) GCKKCNH2CYP1A2ABCB1CYP3A4
SCHEMBL12742046 0.91 GCK (0.72) GCKKCNH2CYP1A2ABCB1CYP3A4
SCHEMBL12782092 0.91 GCK (0.72) GCKKCNH2CYP1A2ABCB1CYP3A4
SCHEMBL1107651 0.89 GCK (0.68) GCKKCNH2CYP1A2ABCB1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012007758-A2 PHARMACEUTICAL FORMULATIONS ASTRAZENECA AB (SE) 2012-01-19 WO disclosed
WO-2012007758-A2 PHARMACEUTICAL FORMULATIONS ASTRAZENECA AB (SE) 2012-01-19 WO disclosed
US-8093252-B2 Crystalline polymorphic form of glucokinase activator ASTRAZENECA AB (SE) 2012-01-10 US disclosed
US-8093252-B2 Crystalline polymorphic form of glucokinase activator ASTRAZENECA AB (SE) 2012-01-10 US disclosed
US-8093252-B2 Crystalline polymorphic form of glucokinase activator ASTRAZENECA AB (SE) 2012-01-10 US disclosed
US-8076481-B2 Chemical process 632 ASTRAZENECA AB (SE) 2011-12-13 US disclosed
US-8076481-B2 Chemical process 632 ASTRAZENECA AB (SE) 2011-12-13 US disclosed
US-8076481-B2 Chemical process 632 ASTRAZENECA AB (SE) 2011-12-13 US disclosed
US-20100210621-A1 CRYSTALLINE POLYMORPHIC FORM 631 ASTRAZENECA AB (SE) 2010-08-19 US disclosed
US-20100210621-A1 CRYSTALLINE POLYMORPHIC FORM 631 ASTRAZENECA AB (SE) 2010-08-19 US disclosed
US-20100210621-A1 CRYSTALLINE POLYMORPHIC FORM 631 ASTRAZENECA AB (SE) 2010-08-19 US disclosed
US-20100210841-A1 CHEMICAL PROCESS 632 ASTRAZENECA AB (SE) 2010-08-19 US disclosed
US-20100210841-A1 CHEMICAL PROCESS 632 ASTRAZENECA AB (SE) 2010-08-19 US disclosed
US-20100210841-A1 CHEMICAL PROCESS 632 ASTRAZENECA AB (SE) 2010-08-19 US disclosed
WO-2010092386-A1 CRYSTALLINE POLYMORPHIC FORM 631 ASTRAZENECA AB (SE) 2010-08-19 WO disclosed
WO-2010092387-A1 PROCESS FOR PREPARATION OF BEZOYL AMINO HETEROCYCLYL COMPOUNDS ASTRAZENECA AB (SE) 2010-08-19 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-20100210841-A1 CHEMICAL PROCESS 632 F12, XDH, REN GCK 2360/4885KCNH2 837/4885CYP1A2 14/4885
US-20100210621-A1 CRYSTALLINE POLYMORPHIC FORM 631 GCKR, GCK, HK1 GCK 2/4885KCNH2 631/4885CYP1A2 1358/4885

“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.