SCHEMBL24801647

SCHEMBL24801647

C=C(CC(=O)OC1(c2ccc(C(F)(F)F)c(F)c2)CCC1)C(=O)NC

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 2/20 0.38
▸ PDE2A O00408 10/20 0.37
▸ HDAC3 O15379 1/20 0.37
▸ HDAC2 Q92769 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.37
▸ KCNN4 O15554 3/20 0.34
▸ CYP11B1 P15538 4/20 0.33
▸ CYP11B2 P19099 4/20 0.33
▸ KIF11 P52732 1/20 0.32

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
SCHEMBL24397909 0.88 HDAC1 (0.40) HDAC1PDE2AHDAC3HDAC2HDAC6
SCHEMBL29601146 0.88 HDAC1 (0.40) HDAC1PDE2AHDAC3HDAC2HDAC6
SCHEMBL24801664 0.87 HDAC1 (0.39) HDAC1PDE2AHDAC3HDAC2HDAC6
SCHEMBL24801165 0.84 SLC6A3 (0.40) HDAC1PDE2AHDAC3HDAC2HDAC6
SCHEMBL25043232 0.80 HDAC1 (0.40) HDAC1PDE2AHDAC3HDAC2HDAC6
SCHEMBL29601371 0.77 SLC6A2 (0.36) —
SCHEMBL24397807 0.77 SLC6A2 (0.36) —
SCHEMBL24801652 0.75 GRM4 (0.31) —
SCHEMBL24398054 0.73 — —
SCHEMBL30304261 0.73 POLB (0.37) PDE2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4359390-A1 ACRYLAMIDE DERIVATIVES USEFUL AS ANTI-INFLAMMATORY AGENTS Sitryx Therapeutics Limited (GB) 2024-05-01 — — EP disclosed
WO-2022269251-A1 ACRYLAMIDE DERIVATIVES USEFUL AS ANTI-INFLAMMATORY AGENTS SITRYX THERAPEUTICS LIMITED (GB) 2022-12-29 — — WO disclosed
WO-2022269251-A1 ACRYLAMIDE DERIVATIVES USEFUL AS ANTI-INFLAMMATORY AGENTS SITRYX THERAPEUTICS LIMITED (GB) 2022-12-29 — — WO disclosed
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