SCHEMBL191108

SCHEMBL191108

CC(C)c1ccccc1Sc1ccnc(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ITGB2 P05107 15/20 0.39
ICAM1 P05362 15/20 0.39
ITGAL P20701 15/20 0.39
GRM5 P41594 1/20 0.35
TRPA1 O75762 1/20 0.35
LMNA P02545 1/20 0.34
HPGD P15428 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
SCHEMBL191123 0.80 AR (0.41) ICAM1GRM5TRPA1HPGD
SCHEMBL191204 0.79 HPGD (0.44) GRM5TRPA1LMNAHPGD
SCHEMBL14562023 0.74 ITGB2 (0.67) ITGB2ICAM1ITGAL
SCHEMBL190818 0.74 SIRT2 (0.44) GRM5TRPA1LMNA
SCHEMBL14113377 0.74 SLC6A4 (0.50) LMNA
SCHEMBL191141 0.73 TRPA1 (0.47) GRM5TRPA1LMNAHPGD
SCHEMBL191746 0.73 ALDH1A1 (0.40) ITGALGRM5TRPA1HPGD
SCHEMBL192450 0.73 AR (0.39) ITGB2ICAM1ITGALGRM5TRPA1
SCHEMBL2888693 0.73 GABRA1 (0.41) LMNAHPGD
SCHEMBL4808650 0.72 GABRA1 (0.48) ITGB2ICAM1ITGALLMNAHPGD

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 6 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
CN-101437512-A Glucokinase activators ARRAY BIOPHARMA INC (US) 2009-05-20 CN 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 ITGB2 4540/4885ICAM1 4252/4885ITGAL 4182/4885

“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.