SCHEMBL190731

SCHEMBL190731

Cc1csc(Nc2cc(Oc3cccc4ncccc34)c(Br)cn2)n1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GCK P35557 14/20 0.45
CACNA2D1 P54289 1/20 0.43
BRAF P15056 1/20 0.41
CCR4 P51679 2/20 0.41
ALDH1A1 P00352 2/20 0.38
GAA P10253 2/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 1/20 0.38
KDM4E B2RXH2 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
SCHEMBL191010 0.86 NPC1 (0.48) CCR4GAAMAPT
SCHEMBL190948 0.86 KCNN1 (0.49) ALDH1A1MAPTKDM4E
SCHEMBL190721 0.84 GCK (0.49) GCKCACNA2D1BRAFCCR4
SCHEMBL190453 0.83 GCK (0.48) GCKCACNA2D1
SCHEMBL192859 0.83 GCK (0.53) GCKCACNA2D1CCR4
SCHEMBL191400 0.83 GCK (0.44) GCKCACNA2D1BRAFCCR4
SCHEMBL191338 0.82 BRAF (0.37) GCKCACNA2D1BRAFCCR4ALDH1A1
SCHEMBL2657620 0.81 GCK (0.44) GCKALDH1A1GAAMAPTHPGD
SCHEMBL191705 0.80 GCK (0.37) GCKCACNA2D1BRAFCCR4ALDH1A1
SCHEMBL190861 0.79 GCK (0.40) GCKCACNA2D1BRAFHPGD

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
EP-1986645-B1 GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC (US) 2012-01-04 EP disclosed
US-8022222-B2 Glucokinase activators ARRAY BIOPHARMA, INC. (US) 2011-09-20 US disclosed
US-20090247526-A1 GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC. (US) 2009-10-01 US disclosed
EP-1986645-A1 GLUCOKINASE ACTIVATORS Array Biopharma, Inc. (US) 2008-11-05 EP disclosed
WO-2007089512-A1 GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC. (US) 2007-08-09 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-20090247526-A1 GLUCOKINASE ACTIVATORS GCKR, GCK, GALK1 GCK 2/4885CACNA2D1 4209/4885BRAF 2352/4885

“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.