SCHEMBL769485

SCHEMBL769485

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nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.70
GSTK1 Q9Y2Q3 1/20 0.70
GLO1 Q04760 2/20 0.61
NOD1 Q9Y239 7/20 0.46
FOLH1 Q04609 2/20 0.41
GRM8 O00222 1/20 0.40
GRM6 O15303 1/20 0.40
GRIN2D O15399 1/20 0.40
GRIN3B O60391 1/20 0.40
GSR P00390 1/20 0.40
CYP1A2 P05177 1/20 0.40
GRIK1 P39086 1/20 0.40
GRM5 P41594 1/20 0.40
GRIA1 P42261 1/20 0.40
GRIA2 P42262 1/20 0.40
GRIA3 P42263 1/20 0.40
SLC1A3 P43003 1/20 0.40
SLC1A2 P43004 1/20 0.40
SLC1A1 P43005 1/20 0.40
GRIA4 P48058 1/20 0.40

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
SCHEMBL10935016 1.00 PTGS1 (0.70) PTGS1GSTK1GLO1NOD1FOLH1
SCHEMBL13561368 1.00 PTGS1 (0.70) PTGS1GSTK1GLO1NOD1FOLH1
SCHEMBL1514772 1.00 PTGS1 (0.70) PTGS1GSTK1GLO1NOD1FOLH1
SCHEMBL20077367 0.88 PTGS1 (0.68) PTGS1GSTK1GLO1NOD1FOLH1
SCHEMBL22015916 0.87 PTGS1 (0.67) PTGS1GSTK1GLO1NOD1FOLH1
SCHEMBL22015845 0.86 PTGS1 (0.65) PTGS1GSTK1GLO1NOD1FOLH1
Glutathione SCHEMBL3747118 0.86 PTGS1 (0.90) PTGS1GSTK1GLO1NOD1FOLH1
Glutathione SCHEMBL1237560 0.86 PTGS1 (0.90) PTGS1GSTK1GLO1NOD1FOLH1
Glutathione SCHEMBL3747125 0.86 PTGS1 (0.90) PTGS1GSTK1GLO1NOD1FOLH1
Glutathione SCHEMBL27807172 0.85 PTGS1 (0.88) PTGS1GSTK1GLO1NOD1FOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-60232071-A None JP disclosed
US-8551963-B2 Imidazolothiazole compounds and methods of use thereof AMBIT BIOSCIENCES CORPORATION (US) 2013-10-08 US disclosed
US-20120070410-A1 IMIDAZOLOTHIAZOLE COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION 2012-03-22 US disclosed
EP-2358725-A1 Imidazolothiazole compounds as modulators of protein kinase Ambit Biosciences Corporation (US) 2011-08-24 EP disclosed
WO-2010054058-A1 IMIDAZOLOTHIAZOLE COMPOUNDS AS MODULATORS OF PROTEIN KINASE AMBIT BIOSCIENCE CORPORATION (US) 2010-05-14 WO disclosed
US-20050008665-A1 Cosmetic or dermatological active ingredient combination BEIERSDORF AG 2005-01-13 US disclosed
EP-1455744-A2 COSMETIC AND/OR DERMATOLOGICAL ACTIVE INGREDIENT COMBINATION Beiersdorf AG (DE) 2004-09-15 EP disclosed
WO-2003032941-A2 COSMETIC AND/OR DERMATOLOGICAL ACTIVE INGREDIENT COMBINATION BEIERSDORF AG (DE) 2003-04-24 WO disclosed
JP-S60232071-A PREPARATION OF SEASONING HAVING GOOD BODY, AND FOOD HAVING IMPROVED BODY AJINOMOTO CO INC 1985-11-18 JP 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 (2 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-20050008665-A1 Cosmetic or dermatological active ingredient combination SDHA, CUTA, HDAC8 PTGS1 779/4885GSTK1 506/4885GLO1 671/4885
US-20120070410-A1 IMIDAZOLOTHIAZOLE COMPOUNDS AND METHODS OF USE THEREOF GRK2, GRK3, GRK4 PTGS1 1156/4885GSTK1 376/4885GLO1 3040/4885

“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.