SCHEMBL29925870

SCHEMBL29925870

CC(C)(C)[Si](C)(C)Oc1ccc2c(c1)c(-c1cncc(CCOCCOCCOS(C)(=O)=O)c1)nn2C1CCCCO1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KRAS P01116 1/20 0.34
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 1/20 0.33

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
SCHEMBL27032217 1.00 KRAS (0.34) KRASRXRARXRBRXRG
SCHEMBL29925435 0.91 RXRA (0.31) KRASRXRARXRBRXRG
SCHEMBL27032602 0.91 RXRA (0.31) KRASRXRARXRBRXRG
SCHEMBL27128884 0.91 RXRA (0.31) KRASRXRARXRBRXRG
SCHEMBL27032535 0.91 RXRA (0.35) RXRARXRBRXRG
SCHEMBL29925779 0.91 RXRA (0.35) RXRARXRBRXRG
SCHEMBL29925772 0.91 RXRA (0.35) RXRARXRBRXRG
SCHEMBL29926053 0.89 RXRA (0.34) RXRARXRBRXRG
SCHEMBL29925882 0.88 RXRA (0.35) RXRARXRBRXRG
SCHEMBL27032237 0.88 RXRA (0.35) RXRARXRBRXRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4308570-A1 MACROCYCLIC LRRK2 KINASE INHIBITORS Les Laboratoires Servier (FR) 2024-01-24 EP disclosed
WO-2022194976-A1 MACROCYCLIC LRRK2 KINASE INHIBITORS LES LABORATOIRES SERVIER (FR) 2022-09-22 WO disclosed