SCHEMBL4350707

SCHEMBL4350707

CCC(O)=S.CCCCCCCCCCCCCCCCCCC(C)C(=S)OCCCCCCCCCCCC

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.44
CA12 O43570 3/20 0.44
CA2 P00918 3/20 0.44
CA9 Q16790 3/20 0.44
NAAA Q02083 1/20 0.42
ACE2 Q9BYF1 1/20 0.39
HCAR2 Q8TDS4 1/20 0.37
EPHX1 P07099 1/20 0.36
TSHR P16473 2/20 0.35
FFAR4 Q5NUL3 1/20 0.35
FFAR1 O14842 1/20 0.35
GPR84 Q9NQS5 2/20 0.34
LPAR2 Q9HBW0 1/20 0.34
LPAR3 Q9UBY5 1/20 0.34

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
SCHEMBL9698545 0.88 CA1 (0.44) CA1CA12CA2CA9ACE2
SCHEMBL20474136 0.78 ACE2 (0.46) CA1ACE2FFAR4FFAR1GPR84
SCHEMBL11814745 0.78 CA1 (0.45) CA1CA12CA2CA9ACE2
SCHEMBL560663 0.76 CA1 (0.40) CA1CA12CA2CA9ACE2
SCHEMBL7749017 0.76 CA1 (0.40) CA1CA12CA2CA9ACE2
SCHEMBL31142399 0.76 CA1 (0.40) CA1CA12CA2CA9ACE2
SCHEMBL9577842 0.76 CA1 (0.40) CA1CA12CA2CA9ACE2
SCHEMBL1823283 0.76 CA1 (0.40) CA1CA12CA2CA9ACE2
SCHEMBL9696166 0.75 CA1 (0.39) CA1CA12CA2CA9ACE2
SCHEMBL9014431 0.74 CA1 (0.45) CA1ACE2

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
US-20090169772-A1 RETARDATION FILM, METHOD FOR PRODUCING RETARDATION FILM, POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY KONICA MINOLTA OPTO, INC. (JP) 2009-07-02 US disclosed