SCHEMBL28301190

SCHEMBL28301190

C=C(C)C(=O)C(CC)CCCCCCCCCCCCCCC

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 7/20 0.53
▸ MAPK1 P28482 1/20 0.48
▸ CA1 P00915 5/20 0.47
▸ GRIK1 P39086 1/20 0.43
▸ GRIK2 Q13002 1/20 0.43
▸ TSHR P16473 2/20 0.43
▸ GPR84 Q9NQS5 3/20 0.42
▸ FFAR1 O14842 1/20 0.42
▸ MAPT P10636 1/20 0.41
▸ LCK P06239 1/20 0.41
▸ PPARD Q03181 1/20 0.41
▸ ZDHHC20 Q5W0Z9 1/20 0.41
▸ ZDHHC2 Q9UIJ5 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
SCHEMBL18869121 0.92 CA2 (0.57) CA2CA1GRIK1GRIK2TSHR
Ammonia Solution, Strong SCHEMBL31622304 0.82 TSHR (0.48) CA2MAPK1CA1GRIK1GRIK2
SCHEMBL29968461 0.79 CA2 (0.56) CA2MAPK1CA1GRIK1GRIK2
SCHEMBL11973540 0.79 CA2 (0.45) CA2MAPK1CA1GRIK1GRIK2
SCHEMBL29488726 0.79 CA2 (0.56) CA2MAPK1CA1GRIK1GRIK2
SCHEMBL2187996 0.79 CA2 (0.56) CA2MAPK1CA1GRIK1GRIK2
SCHEMBL2495651 0.79 CA2 (0.56) CA2MAPK1CA1GRIK1GRIK2
SCHEMBL11973373 0.79 CA2 (0.45) CA2MAPK1CA1GRIK1GRIK2
SCHEMBL5692168 0.79 CA2 (0.56) CA2MAPK1CA1GRIK1GRIK2
SCHEMBL14535364 0.79 CA2 (0.56) CA2MAPK1CA1GRIK1GRIK2

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-105592867-B Hardenable Multi-Part Acrylic Composition 璐彩特国际特殊聚合物和树脂有限公司 2019-06-25 — — CN disclosed
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