SCHEMBL191129

SCHEMBL191129

Cc1cccc(C)c1Sc1ccnc(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
AR P10275 2/20 0.40
TYMS P04818 4/20 0.37
GRM5 P41594 2/20 0.36
TRPA1 O75762 1/20 0.35
SRC P12931 1/20 0.34
RECQL P46063 1/20 0.34
LOX P28300 1/20 0.34
LOXL3 P58215 1/20 0.34
LOXL2 Q9Y4K0 1/20 0.34
MAPK14 Q16539 1/20 0.34
SMARCA2 P51531 1/20 0.33
SMARCA4 P51532 1/20 0.33

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 0.85 AR (0.41) ALDH1A1ARGRM5TRPA1RECQL
SCHEMBL190493 0.82 ALDH1A1 (0.57) ALDH1A1GRM5TRPA1RECQLLOX
SCHEMBL190886 0.75 ALDH1A1 (0.53) ALDH1A1TYMSGRM5
SCHEMBL191141 0.74 TRPA1 (0.47) ALDH1A1GRM5TRPA1RECQLLOX
SCHEMBL31337817 0.73 SRC (0.48) SRCLOXLOXL3LOXL2MAPK14
SCHEMBL190876 0.72 PTGIR (0.45) ALDH1A1
SCHEMBL1146435 0.71
SCHEMBL191746 0.71 ALDH1A1 (0.40) ALDH1A1GRM5TRPA1
SCHEMBL191183 0.71 L3MBTL1 (0.47) ALDH1A1GRM5RECQLLOXLOXL3
SCHEMBL191204 0.70 HPGD (0.44) ALDH1A1GRM5TRPA1

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 ALDH1A1 1869/4885AR 4276/4885TYMS 2474/4885

“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.