SCHEMBL20044964

SCHEMBL20044964

CCCCCCc1ccc2cc3c(C#C[Si](C(C)C)(C(C)C)C(C)C)c4cc5sccc5cc4c(C#C[Si](C(C)C)(C(C)C)C(C)C)c3cc2c1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 2/20 0.32
PLA2G4A P47712 2/20 0.32
S1PR3 Q99500 1/20 0.32
S1PR4 O95977 1/20 0.32
S1PR5 Q9H228 1/20 0.32
TLR8 Q9NR97 4/20 0.31
BDKRB2 P30411 1/20 0.30

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
SCHEMBL20044974 0.89 S1PR1 (0.37) S1PR1S1PR3S1PR4S1PR5TLR8
SCHEMBL20044963 0.86 SIGMAR1 (0.37) S1PR1S1PR4S1PR5TLR8
SCHEMBL650203 0.81 DYRK1A (0.33)
SCHEMBL648632 0.81 DYRK1A (0.33)
SCHEMBL4584539 0.79 DYRK1A (0.31)
SCHEMBL12591167 0.78
SCHEMBL1884100 0.78 S1PR4 (0.30) S1PR1S1PR4S1PR5
SCHEMBL12591168 0.77 DYRK1A (0.31)
SCHEMBL20044975 0.73 TLR8 (0.33) S1PR1S1PR4S1PR5TLR8
SCHEMBL28384923 0.72 PTGS2 (0.44) TLR8

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-20180102222-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME FUJIFILM CORPORATION (JP) 2018-04-12 US disclosed
US-20180102222-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME FUJIFILM CORPORATION (JP) 2018-04-12 US disclosed