SCHEMBL5445954

SCHEMBL5445954

CCCCC(CC)(C(=O)O)C(C)C

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.33
ARG1 P05089 1/20 0.33
ARG2 P78540 1/20 0.33
AKR1B1 P15121 1/20 0.33
ACE2 Q9BYF1 1/20 0.33
MAPK1 P28482 1/20 0.33
GPR84 Q9NQS5 3/20 0.32
CA1 P00915 2/20 0.32
EPHX1 P07099 1/20 0.32
FFAR1 O14842 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
SCHEMBL11589986 0.94 CES2 (0.37) ARG1ARG2AKR1B1ACE2GPR84
SCHEMBL29184106 0.87 ALDH1A1 (0.33) ARG1ARG2
SCHEMBL27346962 0.84 LCK (0.37) CA2AKR1B1ACE2MAPK1GPR84
SCHEMBL11415105 0.83 GPR84 (0.36) CA2AKR1B1MAPK1GPR84FFAR1
SCHEMBL2303259 0.82 ALDH1A1 (0.33) ARG1ARG2
SCHEMBL6249440 0.80 CA1 (0.38) CA2CA1
SCHEMBL28374751 0.80 CES2 (0.40) ACE2GPR84FFAR1
SCHEMBL7766545 0.80 ACE2 (0.43) CA2ACE2GPR84CA1FFAR1
SCHEMBL30807102 0.79 CTSK (0.37) CA2CA1
SCHEMBL31175366 0.79 ALDH1A1 (0.53) FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160020003-A1 OXIDE SUPERCONDUCTOR COMPOSITION, OXIDE SUPERCONDUCTOR WIRE, AND PRODUCTION METHOD FOR OXIDE SUPERCONDUCTOR WIRE SWCC SHOWA CABLE SYSTEMS CO., LTD (JP) 2016-01-21 US disclosed
US-8617648-B2 Imaging members and method of treating an imaging member XEROX CORPORATION (US) 2013-12-31 US disclosed
US-20070178396-A1 Imaging members and method of treating an imaging member XEROX CORPORATION 2007-08-02 US disclosed