SCHEMBL9699187

SCHEMBL9699187

C=CCOC(=O)N1CC(CC2=C(C(=O)O)N3C(=O)[C@H]([C@@H](C)O[Si](C)(C)C(C)(C)C)[C@H]3C2)C1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.33
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
MGLL Q99685 1/20 0.32
ESR1 P03372 1/20 0.32
CHRM1 P11229 1/20 0.32
SLC6A4 P31645 1/20 0.32
KCNH2 Q12809 1/20 0.32
SLC29A1 Q99808 1/20 0.32

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
SCHEMBL9698230 0.92 ESR1 (0.34) FAAHKDM4ELMNAMGLLESR1
SCHEMBL9697860 0.88 ESR1 (0.34) FAAHKDM4ELMNAMGLLESR1
SCHEMBL9386828 0.87 FAAH (0.33) FAAHKDM4ELMNAMGLLESR1
SCHEMBL9696652 0.85
SCHEMBL9699045 0.85
SCHEMBL9696785 0.85 KDM4E (0.42) FAAHKDM4ELMNAMGLLESR1
SCHEMBL9697780 0.84 FAAH (0.32) FAAHKDM4ELMNAMGLLESR1
SCHEMBL9724588 0.83 ESR1 (0.35) FAAHKDM4ELMNAMGLLESR1
SCHEMBL9383921 0.83 ESR1 (0.35) FAAHKDM4ELMNAMGLLESR1
SCHEMBL9386771 0.83 ESR1 (0.35) FAAHKDM4ELMNAMGLLESR1

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
WO-1992002521-A1 1-AZABICYCLO[3.2.0]HEPT-2-ENE-2-CARBOXYLIC ACID COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-02-20 WO disclosed