SCHEMBL838004

SCHEMBL838004

Cc1cnc(NC(=O)C(O)COC(C)C)cn1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GCK P35557 8/20 0.45
NOTUM Q6P988 1/20 0.43
IDO1 P14902 4/20 0.38
MAPT P10636 2/20 0.37
NPC1 O15118 1/20 0.37
LMNA P02545 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
DEGS1 O15121 1/20 0.36
KCNH2 Q12809 4/20 0.35
CHEK1 O14757 2/20 0.35
KDM4E B2RXH2 1/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
HSD17B10 Q99714 1/20 0.34
ABL1 P00519 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
SCHEMBL838003 1.00 GCK (0.45) GCKNOTUMIDO1MAPTNPC1
SCHEMBL839825 0.87 GCK (0.43) GCKNOTUMIDO1KCNH2CHEK1
SCHEMBL839153 0.87 GCK (0.43) GCKNOTUMIDO1KCNH2CHEK1
SCHEMBL839154 0.87 GCK (0.43) GCKNOTUMIDO1KCNH2CHEK1
SCHEMBL839058 0.86 NOTUM (0.45) GCKNOTUMIDO1MAPTKCNH2
SCHEMBL839059 0.86 NOTUM (0.45) GCKNOTUMIDO1MAPTKCNH2
SCHEMBL1848972 0.84 NOTUM (0.38) GCKNOTUMIDO1MAPTNPC1
SCHEMBL839005 0.84 NOTUM (0.38) GCKNOTUMIDO1KCNH2CHEK1
SCHEMBL839004 0.84 NOTUM (0.38) GCKNOTUMIDO1KCNH2CHEK1
SCHEMBL839100 0.83 GCK (0.45) GCKNOTUMIDO1MAPTKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143263-B2 Therapeutic agents ASTRAZENECA AB (SE) 2012-03-27 US disclosed
CN-102171213-A Pyrazolo [3, 4] pyrimidin-4-yl derivatives and their uses to treat diabetes and obesity ASTRAZENECA AB 2011-08-31 CN disclosed
EP-2324028-A2 THERAPEUTIC AGENTS 414 AstraZeneca AB (SE) 2011-05-25 EP disclosed
US-20100093757-A1 THERAPEUTIC AGENTS 414 ASTRAZENECA AB (SE) 2010-04-15 US disclosed
WO-2010015849-A2 THERAPEUTIC AGENTS 414 ASTRAZENECA AB (SE) 2010-02-11 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 (1 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-20100093757-A1 THERAPEUTIC AGENTS 414 GCK, GCKR, GPR119 GCK 1/4885NOTUM 1194/4885IDO1 3277/4885

“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.