SCHEMBL1581871

SCHEMBL1581871

CS(=O)(=O)c1ccc([C@]2(C(=O)Nc3nccs3)C[C@@H]2C2CCCCC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GCK P35557 13/20 1.00
TSHR P16473 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
MAPT P10636 2/20 0.46
HTT P42858 2/20 0.46
USP2 O75604 1/20 0.46
LMNA P02545 1/20 0.46
STAT3 P40763 1/20 0.46
HSD17B10 Q99714 1/20 0.46
MAPK1 P28482 1/20 0.46
ALDH1A1 P00352 3/20 0.45

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
SCHEMBL362258 1.00 GCK (1.00) GCKTSHRSMN1; SMN2MEN1KMT2A
SCHEMBL29225690 1.00 GCK (1.00) GCKTSHRSMN1; SMN2MEN1KMT2A
SCHEMBL2662321 1.00 GCK (1.00) GCKTSHRSMN1; SMN2MEN1KMT2A
SCHEMBL1581869 1.00 GCK (1.00) GCKTSHRSMN1; SMN2MEN1KMT2A
SCHEMBL1581876 0.99 GCK (0.98) GCKTSHRSMN1; SMN2MEN1KMT2A
SCHEMBL13757055 0.99 GCK (0.98) GCKTSHRSMN1; SMN2MEN1KMT2A
SCHEMBL1582183 0.90 GCK (0.82) GCKTSHRSMN1; SMN2MEN1KMT2A
SCHEMBL2666188 0.90 GCK (0.82) GCKTSHRSMN1; SMN2MEN1KMT2A
SCHEMBL13757036 0.90 GCK (0.81) GCKTSHRSMN1; SMN2MEN1KMT2A
SCHEMBL1581632 0.90 GCK (0.81) GCKTSHRSMN1; SMN2MEN1KMT2A

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
US-7576108-B2 Substituted arylcyclopropylacetamides as glucokinase activators ELI LILLY AND COMPANY (US) 2009-08-18 US claimed
EP-1585739-B1 SUBSTITUTED ARYLCYCLOPROPYLACETAMIDES AS GLUCOKINASE ACTIVATORS LILLY CO ELI (US) 2011-04-20 EP disclosed
US-7576108-B2 Substituted arylcyclopropylacetamides as glucokinase activators ELI LILLY AND COMPANY (US) 2009-08-18 US disclosed
US-20060111353-A1 Substituted arylcyclopropylacetamides as glucokinase activators ELI LILLY AND COMPANY 2006-05-25 US disclosed
EP-1585739-A1 SUBSTITUTED ARYLCYCLOPROPYLACETAMIDES AS GLUCOKINASE ACTIVATORS ELI LILLY AND COMPANY (US) 2005-10-19 EP disclosed
WO-2004063179-A1 SUBSTITUTED ARYLCYCLOPROPYLACETAMIDES AS GLUCOKINASE ACTIVATORS ELI LILLY AND COMPANY (US) 2004-07-29 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-20060111353-A1 Substituted arylcyclopropylacetamides as glucokinase activators GCK, GCKR, GALK1 GCK 1/4885TSHR 2867/4885SMN1; SMN2 4420/4885

“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.