SCHEMBL29459306

SCHEMBL29459306

CCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)C(=O)OC(CCCC)CCCCCCC

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.53
CA1 P00915 2/20 0.48
ZDHHC7 Q9NXF8 1/20 0.46
MAPK1 P28482 2/20 0.44
FAAH O00519 1/20 0.44
GRIK1 P39086 2/20 0.43
GRIK2 Q13002 2/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
GPR84 Q9NQS5 4/20 0.42
FFAR1 O14842 1/20 0.42
MAPT P10636 2/20 0.42
LCK P06239 1/20 0.41
PPARD Q03181 1/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.41
ZDHHC2 Q9UIJ5 1/20 0.41
SLC1A2 P43004 1/20 0.41
SLC1A1 P43005 1/20 0.41

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
SCHEMBL20512291 1.00 CA2 (0.53) CA2CA1ZDHHC7MAPK1FAAH
SCHEMBL297378 0.98 CA2 (0.50) CA2CA1ZDHHC7MAPK1FAAH
SCHEMBL17514315 0.98 CA2 (0.50) CA2CA1ZDHHC7MAPK1FAAH
SCHEMBL2118557 0.98 CA2 (0.50) CA2CA1ZDHHC7MAPK1FAAH
SCHEMBL5355144 0.98 CA2 (0.50) CA2CA1ZDHHC7MAPK1FAAH
SCHEMBL24711085 0.93 CA2 (0.46) CA2CA1ZDHHC7MAPK1FAAH
SCHEMBL1274961 0.93 CA2 (0.59) CA2CA1ZDHHC7MAPK1FAAH
SCHEMBL1490741 0.93 CA2 (0.59) CA2CA1ZDHHC7MAPK1FAAH
SCHEMBL535672 0.93 CA2 (0.59) CA2CA1ZDHHC7MAPK1FAAH
SCHEMBL28899012 0.93 CA2 (0.59) CA2CA1ZDHHC7MAPK1FAAH

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
CN-112094607-B Water-based structural sealant and preparation method thereof 临海市春竹粘胶有限公司 2022-04-15 CN disclosed