SCHEMBL8377208

SCHEMBL8377208

CCCCCCCCOC(=O)CNC

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.64
EPHX1 P07099 1/20 0.60
FAAH O00519 2/20 0.58
RAD52 P43351 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
DGKA P23743 1/20 0.53
HTR2C P28335 1/20 0.51
ACHE P22303 6/20 0.48
TSHR P16473 2/20 0.48
PRSS1 P07477 1/20 0.46
PRSS2 P07478 1/20 0.46
PRSS3 P35030 1/20 0.46

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
SCHEMBL4883420 1.00 NAAA (0.64) NAAAEPHX1FAAHRAD52NPSR1
SCHEMBL81047 1.00 NAAA (0.64) NAAAEPHX1FAAHRAD52NPSR1
SCHEMBL7519633 1.00 NAAA (0.64) NAAAEPHX1FAAHRAD52NPSR1
SCHEMBL8379909 1.00 NAAA (0.64) NAAAEPHX1FAAHRAD52NPSR1
SCHEMBL5267200 1.00 NAAA (0.64) NAAAEPHX1FAAHRAD52NPSR1
SCHEMBL6566958 0.98 NAAA (0.62) NAAAEPHX1FAAHRAD52NPSR1
SCHEMBL394098 0.98 NAAA (0.62) NAAAEPHX1FAAHRAD52NPSR1
Hydrochloric Acid SCHEMBL5267197 0.98 NAAA (0.62) NAAAEPHX1FAAHRAD52NPSR1
SCHEMBL27285973 0.98 NAAA (0.62) NAAAEPHX1FAAHRAD52NPSR1
SCHEMBL168311 0.98 NAAA (0.61) NAAAEPHX1FAAHRAD52NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5986042-A Cross-linked polymer MITSUI CHEMICALS, INC. (JP) 1999-11-16 US disclosed
EP-0856539-A1 Cross-linked polymer Mitsui Chemicals, Inc. (JP) 1998-08-05 EP disclosed