SCHEMBL8553467

SCHEMBL8553467

O=C(CN1C(=O)CC1Oc1ccccc1O)NCCCCCCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.48
GAA P10253 1/20 0.48
GFER P55789 1/20 0.48
TRPV1 Q8NER1 4/20 0.46
TSHR P16473 1/20 0.42
ALDH1A1 P00352 2/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
EPHX2 P34913 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ASAH1 Q13510 1/20 0.40
NAMPT P43490 1/20 0.40

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
SCHEMBL8555006 0.89 TRPV1 (0.46) LMNAGAAGFERTRPV1TSHR
SCHEMBL8554387 0.89 TRPV1 (0.46) LMNAGAAGFERTRPV1TSHR
SCHEMBL8549732 0.88 TRPV1 (0.45) LMNAGAAGFERTRPV1TSHR
SCHEMBL8552106 0.88 TRPV1 (0.50) LMNAGAAGFERTRPV1TSHR
SCHEMBL8553418 0.87 TRPV1 (0.43) LMNAGAAGFERTRPV1TSHR
SCHEMBL8553481 0.86 TRPV1 (0.42) LMNAGAAGFERTRPV1TSHR
SCHEMBL8555180 0.85 TRPV1 (0.42) LMNAGAAGFERTRPV1TSHR
SCHEMBL8621833 0.84 TRPV1 (0.41) LMNAGAAGFERTRPV1TSHR
SCHEMBL8551155 0.83 TRPV1 (0.50) LMNAGAAGFERTRPV1TSHR
SCHEMBL8553916 0.83 ADAMTS5 (0.48) LMNATRPV1TSHRALDH1A1L3MBTL1

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
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
EP-0840725-A1 AZETIDINONE DERIVATIVES FOR THE TREATMENT OF ATHEROSCLEROSIS SMITHKLINE BEECHAM PLC (GB) 1998-05-13 EP disclosed
WO-1997002242-A1 AZETIDINONE DERIVATIVES FOR THE TREATMENT OF ATHEROSCLEROSIS SMITHKLINE BEECHAM PLC (GB) 1997-01-23 WO disclosed