SCHEMBL1581870

SCHEMBL1581870

CS(=O)(=O)c1ccc(/C(=C\CC2CCCCC2)CO)cc1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
PTGS2 P35354 6/20 0.40
MEN1 O00255 1/20 0.39
CA2 P00918 1/20 0.39
PTGS1 P23219 2/20 0.38
POLB P06746 1/20 0.38
RORC P51449 1/20 0.38
ESR2 Q92731 1/20 0.36

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
SCHEMBL1581873 1.00 KMT2A (0.47) KMT2APTGS2MEN1CA2PTGS1
SCHEMBL1581754 0.81 KMT2A (0.49) KMT2APTGS2MEN1ESR2
SCHEMBL1581752 0.81 KMT2A (0.49) KMT2APTGS2MEN1ESR2
SCHEMBL4483872 0.81 KMT2A (0.49) KMT2APTGS2MEN1ESR2
SCHEMBL27498986 0.79 KMT2A (0.38) KMT2APTGS2MEN1POLBRORC
SCHEMBL4486333 0.79 KMT2A (0.47) KMT2APTGS2
SCHEMBL1582009 0.79 KMT2A (0.47) KMT2APTGS2
SCHEMBL1582005 0.79 KMT2A (0.47) KMT2APTGS2
SCHEMBL2645319 0.78 AKR1C3 (0.54) KMT2APTGS2
SCHEMBL2645317 0.78 AKR1C3 (0.54) KMT2APTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 KMT2A 1603/4885PTGS2 1483/4885MEN1 4564/4885

“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.