SCHEMBL4476926

SCHEMBL4476926

CS(=O)(=O)c1ccc(C(=CC2CCCCC2)CO)s1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOX P28300 2/20 0.33
LOXL2 Q9Y4K0 1/20 0.33
HRH1 P35367 1/20 0.32
CCR3 P51677 1/20 0.32
HPGD P15428 2/20 0.31
NPC1 O15118 1/20 0.31
TP53 P04637 1/20 0.31
TSHR P16473 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HTT P42858 2/20 0.31
LMNA P02545 1/20 0.31
PPARG P37231 1/20 0.31
NCOA2 Q15596 1/20 0.31
NCOA1 Q15788 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
NCOA3 Q9Y6Q9 1/20 0.31
ALDH1A1 P00352 3/20 0.30
HSP90AA1 P07900 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL2652205 1.00 LOX (0.33) LOXLOXL2HRH1CCR3HPGD
SCHEMBL4476917 1.00 LOX (0.33) LOXLOXL2HRH1CCR3HPGD
SCHEMBL2652615 0.99 HRH1 (0.33) LOXLOXL2HRH1CCR3LMNA
SCHEMBL4468278 0.99 HRH1 (0.33) LOXLOXL2HRH1CCR3LMNA
SCHEMBL4468275 0.99 HRH1 (0.33) LOXLOXL2HRH1CCR3LMNA
SCHEMBL1581797 0.81 DRD2 (0.33) LOXHRH1CCR3LMNAPPARG
SCHEMBL1581795 0.81 DRD2 (0.33) LOXHRH1CCR3LMNAPPARG
SCHEMBL1581799 0.81 DRD2 (0.33) LOXHRH1CCR3LMNAPPARG
SCHEMBL2652218 0.80 LMNA (0.31) LOXLOXL2HPGDHTTLMNA
SCHEMBL2652212 0.80 LMNA (0.31) LOXLOXL2HPGDHTTLMNA

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 2 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 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 LOX 3055/4885LOXL2 4210/4885HRH1 4144/4885

“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.