SCHEMBL1582299

SCHEMBL1582299

CCCS(=O)(=O)c1ccc(C2(C(=O)O)CC2C2CCCCC2)cc1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GCK P35557 1/20 0.45
POLB P06746 3/20 0.38
RAB9A P51151 2/20 0.38
CTDSP1 Q9GZU7 2/20 0.36
NPC1 O15118 1/20 0.36
KMT2A Q03164 1/20 0.36
RORC P51449 3/20 0.35
SLC6A2 P23975 2/20 0.35
NPSR1 Q6W5P4 1/20 0.34
ALDH1A1 P00352 1/20 0.34
SLC6A4 P31645 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
SCHEMBL1581966 0.86 CA2 (0.43) GCKPOLBRAB9ACTDSP1NPC1
SCHEMBL1581747 0.84 GCK (0.60) GCKKMT2AALDH1A1
SCHEMBL2654841 0.84 GCK (0.60) GCKKMT2AALDH1A1
SCHEMBL1582235 0.82 GCK (0.58) GCKKMT2AALDH1A1
SCHEMBL1581983 0.81 GCK (0.49) GCKPOLBKMT2AALDH1A1
SCHEMBL1582297 0.81 GCK (0.47) GCKPOLBKMT2ASLC6A2ALDH1A1
SCHEMBL1344865 0.80 GCK (0.46) GCKKMT2AALDH1A1
SCHEMBL1582479 0.80 ALDH1A1 (0.39) GCKKMT2AALDH1A1
SCHEMBL1582101 0.80 GCK (0.35) GCKPOLBRAB9ACTDSP1NPC1
SCHEMBL1581977 0.79 EPHX2 (0.39) GCKPOLBRAB9AKMT2ARORC

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 1/4885POLB 3839/4885RAB9A 3899/4885

“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.