SCHEMBL3604602

SCHEMBL3604602

COC(=O)c1cc(OC(C)c2ccccc2)cc(O[C@@H](C)CO)c1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 4/20 0.46
PPARG P37231 3/20 0.46
GCK P35557 3/20 0.46
LTB4R Q15722 4/20 0.46
LTB4R2 Q9NPC1 4/20 0.46
FFAR1 O14842 1/20 0.44
GPR139 Q6DWJ6 2/20 0.44
ALOX5 P09917 1/20 0.42
LMNA P02545 1/20 0.42
HPGD P15428 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TSHR P16473 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
SCHEMBL1042331 0.82 LMNA (0.55) GCKLMNAHPGDMEN1KMT2A
SCHEMBL12570192 0.82 MTNR1A (0.44) GPR139KMT2ATSHR
SCHEMBL3604605 0.81 GCK (0.52) PPARGGCKALOX5LMNAHPGD
SCHEMBL2662774 0.78 CA12 (0.56) GCKLMNAHPGDMEN1KMT2A
SCHEMBL1042110 0.78 CA12 (0.56) GCKLMNAHPGDMEN1KMT2A
SCHEMBL4666903 0.78 GCK (0.55) GCKLTB4RLTB4R2FFAR1
SCHEMBL29523345 0.78 LTB4R (0.57) LTB4RLTB4R2FFAR1ALOX5MEN1
SCHEMBL29035407 0.78 LTB4R (0.57) LTB4RLTB4R2FFAR1ALOX5MEN1
SCHEMBL29523814 0.78 LTB4R (0.57) LTB4RLTB4R2FFAR1ALOX5MEN1
SCHEMBL2084645 0.76 GCK (0.59) PPARAPPARGGCKLMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7642263-B2 Heteroaryl benzamide derivatives for use as GLK activators in the treatment of diabetes ASTRAZENECA AB (SE) 2010-01-05 US disclosed
US-20090029905-A1 HETEROARYL BENZAMIDE DERIVATIVES FOR USE AS GLK ACTIVATORS IN THE TREATMENT OF DIABETES ASTRAZENECA AB (SE) 2009-01-29 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 (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-20090029905-A1 HETEROARYL BENZAMIDE DERIVATIVES FOR USE AS GLK ACTIVATORS IN THE TREATMENT OF DIABETES GCK, GCKR, GK PPARA 365/4885PPARG 99/4885GCK 1/4885

“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.