SCHEMBL20142931

SCHEMBL20142931

CC(C)(C)OOC(=O)C(C)(C)C.CCCCC(CC)C(=O)OOOC(C)(C)CC

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.44
CA1 P00915 4/20 0.44
MAPK1 P28482 1/20 0.37
GAA P10253 1/20 0.37
XBP1 P17861 1/20 0.37
ATM Q13315 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
L3MBTL1 Q9Y468 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
SCHEMBL23036028 0.91 CA2 (0.50) CA2CA1MAPK1GAAXBP1
SCHEMBL24902 0.89 CA2 (0.54) CA2CA1MAPK1GAAXBP1
SCHEMBL2788481 0.88 CA2 (0.50) CA2CA1MAPK1GAAXBP1
SCHEMBL9070265 0.87 CA2 (0.49) CA2CA1MAPK1GAAXBP1
SCHEMBL21218993 0.85 CA2 (0.44) CA2CA1MAPK1GAAXBP1
SCHEMBL37317 0.83 CA2 (0.58) CA2CA1MAPK1GAAXBP1
Dodecane SCHEMBL12472594 0.81 CA2 (0.54) CA2CA1MAPK1GAAXBP1
Bicarbonate SCHEMBL28738575 0.81 CA2 (0.54) CA2CA1MAPK1GAAXBP1
SCHEMBL218700 0.80 CA2 (0.58) CA2CA1MAPK1GAAXBP1
SCHEMBL210333 0.80 CA2 (0.61) CA2CA1MAPK1GAAXBP1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4232488-A1 COATING COMPOSITION Jotun A/S (NO) 2023-08-30 EP disclosed
EP-4234643-A2 ANTIFOULING COMPOSITION Jotun A/S (NO) 2023-08-30 EP disclosed
WO-2022090208-A1 COATING COMPOSITION JOTUN A/S (NO) 2022-05-05 WO disclosed
EP-3710538-A1 ANTIFOULING COMPOSITION Jotun A/S (NO) 2020-09-23 EP disclosed
EP-3538614-A1 ANTIFOULING COMPOSITION Jotun A/S (NO) 2019-09-18 EP disclosed
WO-2018087287-A1 ANTIFOULING COMPOSITION JOTUN A/S (NO) 2018-05-17 WO disclosed