SCHEMBL8544946

SCHEMBL8544946

[CH2]C(CC(=O)OCCCCC)C(=O)OCCCCC

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.55
NPSR1 Q6W5P4 2/20 0.51
MAPT P10636 1/20 0.51
MAPK1 P28482 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
RAD52 P43351 1/20 0.47
FAAH O00519 1/20 0.46
TSHR P16473 3/20 0.46
DGKA P23743 1/20 0.46
HTR2C P28335 1/20 0.45
EPHX1 P07099 1/20 0.43
ALDH1A1 P00352 1/20 0.41
HCAR2 Q8TDS4 1/20 0.41
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
HPGD P15428 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
SCHEMBL8516815 0.87 TSHR (0.51) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL8517115 0.87 TSHR (0.55) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL9825370 0.84 NAAA (0.44) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL11403568 0.81 NAAA (0.59) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL6882232 0.81 NAAA (0.55) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL702876 0.79 NAAA (0.62) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL9016837 0.79 NAAA (0.62) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL1722151 0.79 NAAA (0.62) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL12526880 0.79 NAAA (0.57) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL16594571 0.79 NAAA (0.62) NAAANPSR1MAPTMAPK1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0661310-B1 Cyclo-olefincopolymers and process for their preparation TICONA GMBH (DE) 1999-07-21 EP disclosed
EP-0661308-B1 Cyclo-olefin copolymers and process for their preparation TICONA GMBH (DE) 1999-06-02 EP disclosed
US-5756623-A MOLDING MATERIALS FOR COMPRESSION MOLDING HOECHST AG (DE) 1998-05-26 US disclosed
EP-0661310-A2 Cyclo-olefincopolymers and process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1995-07-05 EP disclosed
EP-0661308-A2 Cyclo-olefin copolymers and process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1995-07-05 EP disclosed