SCHEMBL29925779

SCHEMBL29925779

CC(C)(C)[Si](C)(C)Oc1ccc2c(c1)c(-c1cncc(CCOCCOCCO)c1)nn2C1CCCCO1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.35
RXRB P28702 1/20 0.35
RXRG P48443 1/20 0.35
ATR Q13535 1/20 0.31
CYP4F2 P78329 1/20 0.31
CYP4A11 Q02928 1/20 0.31

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
SCHEMBL27032535 1.00 RXRA (0.35) RXRARXRBRXRGATRCYP4F2
SCHEMBL29925772 1.00 RXRA (0.35) RXRARXRBRXRGATRCYP4F2
SCHEMBL27032237 0.92 RXRA (0.35) RXRARXRBRXRG
SCHEMBL29925882 0.92 RXRA (0.35) RXRARXRBRXRG
SCHEMBL27032435 0.92 RXRA (0.35) RXRARXRBRXRG
SCHEMBL29926053 0.91 RXRA (0.34) RXRARXRBRXRGATRCYP4F2
SCHEMBL29925870 0.91 KRAS (0.34) RXRARXRBRXRG
SCHEMBL27032217 0.91 KRAS (0.34) RXRARXRBRXRG
SCHEMBL29925893 0.88 RXRA (0.32) RXRARXRBRXRG
SCHEMBL27130528 0.88 RXRA (0.32) 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