SCHEMBL24865754

SCHEMBL24865754

CNc1ccc(Nc2ccc(N3CC(F)C3)cc2C)cc1OCC=O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 1/20 0.32
PSMD14 O00487 1/20 0.32
USP2 O75604 1/20 0.32
MMP2 P08253 1/20 0.32
P2RX7 Q99572 1/20 0.30

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
SCHEMBL24865829 0.82 CSF1R (0.35) PSMD14USP2MMP2P2RX7
SCHEMBL24865747 0.78 LRRK2 (0.37) LRRK2PSMD14USP2MMP2P2RX7
SCHEMBL24865317 0.75 GAK (0.36)
SCHEMBL24865544 0.73 BCL6 (0.35) LRRK2
SCHEMBL24865611 0.69 BRD4 (0.33) LRRK2
SCHEMBL24865444 0.67 DRD4 (0.48)
SCHEMBL30336937 0.65 DRD2 (0.38) P2RX7
SCHEMBL24864884 0.65 DRD2 (0.38) P2RX7
SCHEMBL25041817 0.62 MAPT (0.48)
SCHEMBL25041636 0.62 MAPT (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023280296-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2023-01-12 WO disclosed