SCHEMBL7315668

SCHEMBL7315668

O=C(O)CC(=O)OCC1CCCCC1

nearest known ligand 0.70

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.70
SLC1A3 P43003 4/20 0.42
SLC1A2 P43004 4/20 0.42
SLC1A1 P43005 4/20 0.42
THRA P10827 2/20 0.40
THRB P10828 2/20 0.40
MIF P14174 1/20 0.38
CYP2D6 P10635 1/20 0.38
ALDH1A1 P00352 2/20 0.38
EPHX1 P07099 3/20 0.37
HPGD P15428 1/20 0.37
KMT2A Q03164 1/20 0.37
PARP15 Q460N3 1/20 0.37
PARP10 Q53GL7 1/20 0.37
NAAA Q02083 1/20 0.36
MGLL Q99685 1/20 0.36
PTGIR P43119 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
SCHEMBL11464663 0.94 LMNA (0.61) LMNASLC1A3SLC1A2SLC1A1THRA
SCHEMBL4004096 0.90 LMNA (0.66) LMNASLC1A3SLC1A2SLC1A1MIF
SCHEMBL1734351 0.87 LMNA (0.62) LMNASLC1A3SLC1A2SLC1A1MIF
SCHEMBL1735477 0.83 LMNA (0.57) LMNASLC1A3SLC1A2SLC1A1MIF
SCHEMBL9715628 0.82 LMNA (1.00) LMNASLC1A3SLC1A2SLC1A1THRA
SCHEMBL13425332 0.82 LMNA (0.58) LMNASLC1A3SLC1A2SLC1A1MIF
SCHEMBL9208258 0.81 LMNA (0.85) LMNASLC1A3SLC1A2SLC1A1THRA
SCHEMBL14895668 0.81 LMNA (0.47) LMNA
SCHEMBL4962640 0.81 LMNA (0.56) LMNATHRBCYP2D6ALDH1A1KMT2A
SCHEMBL20954311 0.80 LMNA (0.55) LMNASLC1A3SLC1A2SLC1A1MIF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5459131-A Renin inhibitors AMERICAN CYANAMID COMPANY (US) 1995-10-17 US disclosed