SCHEMBL8552106

SCHEMBL8552106

O=C(CN1C(=O)CC1Oc1ccccc1)NCCCCCCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 4/20 0.50
ASAH1 Q13510 1/20 0.46
LMNA P02545 2/20 0.45
TSHR P16473 1/20 0.45
FAAH O00519 1/20 0.45
HPGD P15428 2/20 0.44
ALDH1A1 P00352 1/20 0.44
KMT2A Q03164 1/20 0.44
GAA P10253 2/20 0.44
GFER P55789 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
EPHX2 P34913 2/20 0.43

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
SCHEMBL27499495 0.93 LMNA (0.48) TRPV1ASAH1LMNAALDH1A1KMT2A
SCHEMBL8553916 0.93 ADAMTS5 (0.48) TRPV1ASAH1LMNATSHRALDH1A1
SCHEMBL8554190 0.90 TRPV1 (0.43) TRPV1ASAH1LMNATSHRHPGD
SCHEMBL8552214 0.89 TRPV1 (0.42) TRPV1ASAH1LMNATSHRHPGD
SCHEMBL8553467 0.88 LMNA (0.48) TRPV1ASAH1LMNATSHRHPGD
SCHEMBL8551155 0.87 TRPV1 (0.50) TRPV1ASAH1LMNATSHRHPGD
SCHEMBL8554387 0.87 TRPV1 (0.46) TRPV1ASAH1LMNATSHRHPGD
SCHEMBL8555006 0.87 TRPV1 (0.46) TRPV1LMNATSHRHPGDALDH1A1
SCHEMBL8549732 0.86 TRPV1 (0.45) TRPV1LMNATSHRHPGDALDH1A1
SCHEMBL8553418 0.84 TRPV1 (0.43) TRPV1LMNATSHRHPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1197452-A Azetidinone derivatives for treatment of atherosclerosis SMITHKLINE BEECHAM PLC (GB) 1998-10-28 CN claimed
EP-0840725-A1 AZETIDINONE DERIVATIVES FOR THE TREATMENT OF ATHEROSCLEROSIS SMITHKLINE BEECHAM PLC (GB) 1998-05-13 EP claimed
WO-1997002242-A1 AZETIDINONE DERIVATIVES FOR THE TREATMENT OF ATHEROSCLEROSIS SMITHKLINE BEECHAM PLC (GB) 1997-01-23 WO claimed
WO-1997002242-A1 AZETIDINONE DERIVATIVES FOR THE TREATMENT OF ATHEROSCLEROSIS SMITHKLINE BEECHAM PLC (GB) 1997-01-23 WO disclosed