SCHEMBL1581885

SCHEMBL1581885

O=S(=O)(Cc1cccnc1)c1ccc(C(=CC2CCCC2)CO)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 5/20 0.43
▸ LMNA P02545 3/20 0.43
▸ HTT P42858 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ JAK1 P23458 1/20 0.41
▸ NAMPT P43490 5/20 0.39
▸ ALDH1A1 P00352 5/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ C3AR1 Q16581 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ MAPT P10636 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ GAA P10253 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
SCHEMBL1581881 1.00 TSHR (0.43) TSHRLMNAHTTSMN1; SMN2JAK1
SCHEMBL1581906 0.84 SMN1; SMN2 (0.63) TSHRLMNAHTTSMN1; SMN2NAMPT
SCHEMBL1581908 0.84 SMN1; SMN2 (0.63) TSHRLMNAHTTSMN1; SMN2NAMPT
SCHEMBL1582019 0.79 JAK1 (0.43) TSHRLMNAHTTSMN1; SMN2JAK1
SCHEMBL1582017 0.79 JAK1 (0.43) TSHRLMNAHTTSMN1; SMN2JAK1
SCHEMBL1018614 0.73 TSHR (0.69) TSHRLMNAHTTSMN1; SMN2NAMPT
SCHEMBL4486333 0.73 KMT2A (0.47) —
SCHEMBL1582009 0.73 KMT2A (0.47) —
SCHEMBL1582005 0.73 KMT2A (0.47) —
SCHEMBL1582260 0.73 NPSR1 (0.36) ALDH1A1

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 TSHR 2867/4885LMNA 4666/4885HTT 2189/4885

“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.

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