SCHEMBL7844274

SCHEMBL7844274

CC(C)CCCOCCCC(C)C.[Na]

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
ALDH1A1 P00352 1/20 0.36
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
TSHR P16473 1/20 0.32
PTPN1 P18031 1/20 0.31
BLM P54132 1/20 0.31
GBA1 P04062 1/20 0.31

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
SCHEMBL1192955 0.97 LMNA (0.45) LMNAALDH1A1CA12CA1CA2
SCHEMBL19757269 0.94 LMNA (0.43) LMNAALDH1A1CA12CA1CA2
SCHEMBL15082605 0.94 LMNA (0.43) LMNAALDH1A1CA12CA1CA2
SCHEMBL25468178 0.94 LMNA (0.43) LMNAALDH1A1CA12CA1CA2
SCHEMBL12346238 0.94 LMNA (0.43) LMNAALDH1A1CA12CA1CA2
SCHEMBL25468179 0.94 LMNA (0.43) LMNAALDH1A1CA12CA1CA2
SCHEMBL15082606 0.94 LMNA (0.43) LMNAALDH1A1CA12CA1CA2
SCHEMBL26841027 0.94 LMNA (0.43) LMNAALDH1A1CA12CA1CA2
SCHEMBL23696800 0.91 LMNA (0.41) LMNAALDH1A1CA12CA1CA2
SCHEMBL25468180 0.91 LMNA (0.41) LMNAALDH1A1CA12CA1CA2

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-1098883-A4 PROCESS FOR PREPARING HETEROCYCLIC COMPOUNDS LILLY CO ELI (US) 2001-11-14 EP disclosed
EP-1098883-A1 PROCESS FOR PREPARING HETEROCYCLIC COMPOUNDS ELI LILLY AND COMPANY (US) 2001-05-16 EP disclosed
WO-1998054151-A1 PROCESS FOR PREPARING HETEROCYCLIC COMPOUNDS ELI LILLY AND COMPANY (US) 1998-12-03 WO disclosed