SCHEMBL28486992

SCHEMBL28486992

CCCCC(CCOC)C(=O)OC

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.69
CA1 P00915 4/20 0.69
ZDHHC7 Q9NXF8 1/20 0.46
MAPK1 P28482 1/20 0.44
BIRC2 Q13490 5/20 0.41
TSHR P16473 1/20 0.38
SLC1A3 P43003 1/20 0.38
SLC1A2 P43004 1/20 0.38
SLC1A1 P43005 1/20 0.38
ALDH1A1 P00352 1/20 0.38
USP2 O75604 1/20 0.37

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
SCHEMBL8950290 0.90 CA2 (0.83) CA2CA1ZDHHC7MAPK1BIRC2
SCHEMBL21052368 0.88 CA2 (0.80) CA2CA1ZDHHC7MAPK1BIRC2
SCHEMBL2627699 0.86 CA2 (0.77) CA2CA1ZDHHC7MAPK1BIRC2
SCHEMBL7468343 0.86 CA2 (0.77) CA2CA1ZDHHC7MAPK1BIRC2
Hydrochloric Acid SCHEMBL28528409 0.84 CA2 (0.74) CA2CA1ZDHHC7MAPK1BIRC2
SCHEMBL29152695 0.84 CA2 (0.74) CA2CA1ZDHHC7MAPK1BIRC2
SCHEMBL3677110 0.84 CA2 (0.74) CA2CA1ZDHHC7MAPK1BIRC2
SCHEMBL3682239 0.84 CA2 (0.74) CA2CA1ZDHHC7MAPK1BIRC2
SCHEMBL3682221 0.84 CA2 (0.74) CA2CA1ZDHHC7MAPK1BIRC2
SCHEMBL672594 0.84 CA2 (0.74) CA2CA1ZDHHC7MAPK1BIRC2

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-112088007-A Pyridin-2-ylalkylamino substituted hydroximic acids and uses thereof 夏威夷生物技术公司 2020-12-15 CN disclosed