SCHEMBL23129641

SCHEMBL23129641

O=C(OCC1CCCCC1)OCC1CC1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.57
SLC1A3 P43003 4/20 0.43
SLC1A2 P43004 4/20 0.43
SLC1A1 P43005 4/20 0.43
ALOX5 P09917 2/20 0.42
PARP15 Q460N3 2/20 0.41
PARP10 Q53GL7 2/20 0.41
EPHX1 P07099 3/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
THRA P10827 1/20 0.37
THRB P10828 1/20 0.37
NAAA Q02083 1/20 0.36
MGLL Q99685 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
SCHEMBL1669840 0.98 LMNA (0.59) LMNASLC1A3SLC1A2SLC1A1ALOX5
SCHEMBL1672623 0.95 LMNA (0.55) LMNASLC1A3SLC1A2SLC1A1ALOX5
SCHEMBL25381860 0.90 LMNA (0.50) LMNASLC1A3SLC1A2SLC1A1ALOX5
SCHEMBL1444506 0.90 LMNA (0.43) LMNASLC1A3SLC1A2SLC1A1ALOX5
SCHEMBL12987175 0.87 LMNA (0.50) LMNASLC1A3SLC1A2SLC1A1ALOX5
SCHEMBL696997 0.87 LMNA (0.50) LMNASLC1A3SLC1A2SLC1A1ALOX5
SCHEMBL6895798 0.87 LMNA (0.50) LMNASLC1A3SLC1A2SLC1A1ALOX5
SCHEMBL3117465 0.87 ALDH1A1 (0.52) LMNASLC1A3SLC1A2SLC1A1KMT2A
SCHEMBL6032436 0.86 LMNA (0.53) LMNASLC1A3SLC1A2SLC1A1ALOX5
SCHEMBL698390 0.85 LMNA (0.52) LMNASLC1A3SLC1A2SLC1A1ALOX5

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
EP-3154989-B1 BETA-LACTAMASE INHIBITORS VENATORX PHARMACEUTICALS INC (US) 2021-03-24 EP disclosed