SCHEMBL1795779

SCHEMBL1795779

COC(=O)c1ccc(OCCCS(C)(=O)=O)cc1

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.70
RAB9A P51151 4/20 0.62
L3MBTL1 Q9Y468 2/20 0.54
TDP1 Q9NUW8 1/20 0.54
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
STS P08842 1/20 0.51
NPC1 O15118 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
KDM4E B2RXH2 3/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
ALDH1A1 P00352 1/20 0.49
HTT P42858 1/20 0.49
GAA P10253 2/20 0.47
LMNA P02545 1/20 0.47

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
SCHEMBL11682941 0.88 MAPT (0.70) MAPTRAB9AL3MBTL1TDP1CA1
SCHEMBL11680927 0.86 MAPT (0.68) MAPTRAB9AL3MBTL1TDP1CA1
SCHEMBL11680920 0.85 MAPT (0.66) MAPTRAB9AL3MBTL1TDP1CA1
SCHEMBL2469151 0.85 MAPT (0.89) MAPTRAB9AL3MBTL1TDP1CA1
SCHEMBL5054312 0.83 MAPT (0.85) MAPTRAB9AL3MBTL1TDP1CA1
SCHEMBL1963632 0.83 MAPT (0.68) MAPTRAB9AL3MBTL1TDP1CA1
SCHEMBL1951546 0.83 MAPT (1.00) MAPTRAB9AL3MBTL1TDP1CA1
SCHEMBL5400568 0.82 MAPT (0.77) MAPTRAB9AL3MBTL1TDP1CA1
SCHEMBL1793833 0.82 MAPT (0.66) MAPTRAB9AL3MBTL1TDP1CA1
SCHEMBL7937774 0.82 MAPT (0.82) MAPTRAB9AL3MBTL1TDP1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7951826-B2 Obesity; cognition activators; narcolepsy ELI LILLY AND COMPANY (US) 2011-05-31 US disclosed
US-7951826-B2 Obesity; cognition activators; narcolepsy ELI LILLY AND COMPANY (US) 2011-05-31 US disclosed
EP-1861360-B1 PYRROLIDINE DERIVATIVES AS HISTAMINE H3 RECEPTOR ANTAGONISTS LILLY CO ELI (US) 2009-12-02 EP disclosed
EP-1861360-B1 PYRROLIDINE DERIVATIVES AS HISTAMINE H3 RECEPTOR ANTAGONISTS LILLY CO ELI (US) 2009-12-02 EP disclosed
US-20080207732-A1 Pyrrolidine Derivatives as Histamine H3 Receptor Antagonists ELI LILLY AND COMPANY 2008-08-28 US disclosed
US-20080207732-A1 Pyrrolidine Derivatives as Histamine H3 Receptor Antagonists ELI LILLY AND COMPANY 2008-08-28 US disclosed
EP-1861360-A1 PYRROLIDINE DERIVATIVES AS HISTAMINE H3 RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2007-12-05 EP disclosed
WO-2006101808-A1 PYRROLIDINE DERIVATIVES AS HISTAMINE H3 RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 2006-09-28 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-20080207732-A1 Pyrrolidine Derivatives as Histamine H3 Receptor Antagonists HRH3, HCRTR1, HRH4 MAPT 925/4885RAB9A 1369/4885L3MBTL1 1584/4885

“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.