SCHEMBL1582018

SCHEMBL1582018

CCOC(=O)/C(=C/C1CCCCC1)c1ccc(S(C)(=O)=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.46
GCK P35557 1/20 0.42
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
AKR1C3 P42330 5/20 0.40
LMNA P02545 1/20 0.40
PTGS2 P35354 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
NR3C1 P04150 1/20 0.37
AR P10275 1/20 0.37

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
SCHEMBL1582021 1.00 KMT2A (0.46) KMT2AGCKALDH1A1POLBAKR1C3
SCHEMBL1581584 0.99 KMT2A (0.44) KMT2AGCKALDH1A1POLBAKR1C3
SCHEMBL1581586 0.99 KMT2A (0.44) KMT2AGCKALDH1A1POLBAKR1C3
SCHEMBL2646100 0.89 ALDH1A1 (0.41) KMT2AALDH1A1POLBLMNANPSR1
SCHEMBL2646097 0.89 ALDH1A1 (0.41) KMT2AALDH1A1POLBLMNANPSR1
SCHEMBL1581576 0.87 ALDH1A1 (0.39) ALDH1A1POLBLMNANPSR1NR3C1
SCHEMBL1581575 0.87 ALDH1A1 (0.39) KMT2AALDH1A1POLBLMNANPSR1
SCHEMBL1581573 0.87 ALDH1A1 (0.39) ALDH1A1POLBLMNANPSR1NR3C1
SCHEMBL4258522 0.87 ALDH1A1 (0.40) KMT2AGCKALDH1A1POLBLMNA
SCHEMBL4258524 0.87 ALDH1A1 (0.40) KMT2AGCKALDH1A1POLBLMNA

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 5 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
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 KMT2A 1603/4885GCK 1/4885ALDH1A1 510/4885

“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.