SCHEMBL29315213

SCHEMBL29315213

CCCC1CCCCC1C(=O)NC

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA4 P22748 1/20 0.47
GRM4 Q14833 2/20 0.41
CTSK P43235 6/20 0.40
BCHE P06276 1/20 0.35
MME P08473 1/20 0.35
NAAA Q02083 1/20 0.34
CTSL P07711 1/20 0.33
CTSB P07858 1/20 0.33
ADRA2A P08913 2/20 0.33
ADRA2B P18089 2/20 0.33
ADRA2C P18825 2/20 0.33
ADRA1A P35348 1/20 0.33
EPHX1 P07099 1/20 0.33

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
SCHEMBL29315215 0.89 BCHE (0.39) CA1CA2CA4GRM4CTSK
SCHEMBL29315212 0.85 GRM4 (0.42) GRM4CTSKCTSLCTSB
SCHEMBL11290575 0.83 GRM4 (0.41) GRM4CTSKNAAACTSLCTSB
SCHEMBL7066347 0.79 GRM4 (0.41) GRM4CTSKCTSLCTSBEPHX1
SCHEMBL12140495 0.78 CA1 (0.47) CA1CA2CA4CTSKMME
SCHEMBL5909473 0.77 GRM4 (0.56) GRM4CTSKCTSBEPHX1
SCHEMBL2457068 0.77 EPHX1 (0.50) CA1CA2CA4GRM4CTSK
SCHEMBL20979462 0.76 GRM4 (0.38) GRM4CTSKCTSLCTSB
SCHEMBL19217729 0.76 EPHX1 (0.48) CA1CA2CA4GRM4CTSK
SCHEMBL10169316 0.75 GRM4 (0.39) GRM4CTSKCTSLCTSBEPHX1

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-20240239934-A1 FUMARIC ACID DIESTER RESIN, FILM AND POLARIZING PLATE TOSOH CORPORATION (JP) 2024-07-18 US disclosed
US-20240239934-A1 FUMARIC ACID DIESTER RESIN, FILM AND POLARIZING PLATE TOSOH CORPORATION (JP) 2024-07-18 US disclosed