SCHEMBL30242559

SCHEMBL30242559

CC1(C)OB(c2cnc3c(cnn3C3CCCCO3)c2)OC1(C)C

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.38
CYP4A11 Q02928 2/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
RXRG P48443 1/20 0.37
YTHDC1 Q96MU7 1/20 0.34
ATR Q13535 8/20 0.32
KDM5B Q9UGL1 1/20 0.32
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
IRAK4 Q9NWZ3 1/20 0.32
CYP2C19 P33261 1/20 0.32
USP30 Q70CQ3 1/20 0.32
PDGFRB P09619 1/20 0.31
KDR P35968 1/20 0.31
ALPL P05186 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
SCHEMBL12370610 1.00 CYP4F2 (0.38) CYP4F2CYP4A11ALDH1A1LMNAPOLB
SCHEMBL19757602 0.87 CYP4F2 (0.35) CYP4F2CYP4A11ALDH1A1LMNAPOLB
SCHEMBL20463550 0.85 CYP4F2 (0.35) CYP4F2CYP4A11ALDH1A1LMNAPOLB
SCHEMBL983350 0.82 RXRA (0.51) CYP4F2CYP4A11ALDH1A1LMNAPOLB
SCHEMBL29390069 0.82 RXRA (0.51) CYP4F2CYP4A11ALDH1A1LMNAPOLB
SCHEMBL30853264 0.82 IRAK4 (0.36) GSK3AGSK3BIRAK4USP30PDGFRB
SCHEMBL27402947 0.82 IRAK4 (0.36) GSK3AGSK3BIRAK4USP30PDGFRB
SCHEMBL18480146 0.81 CYP4F2 (0.39) CYP4F2CYP4A11ALDH1A1LMNAPOLB
SCHEMBL30470870 0.81 CYP4F2 (0.39) CYP4F2CYP4A11ALDH1A1LMNAPOLB
SCHEMBL27215084 0.81 CYP4F2 (0.36) CYP4F2CYP4A11ATRGSK3AGSK3B

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-4146658-B1 NEW MACROCYCLIC LRRK2 KINASE INHIBITORS ONCODESIGN PREC MEDICINE OPM (FR) 2025-10-29 EP disclosed
EP-4146658-A1 NEW MACROCYCLIC LRRK2 KINASE INHIBITORS Les Laboratoires Servier (FR) 2023-03-15 EP disclosed