SCHEMBL24865747

SCHEMBL24865747

CNc1ncc(Nc2ccc(N3CCC(F)CC3)cc2C)cc1OCC=O

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 4/20 0.37
PSMD14 O00487 1/20 0.36
USP2 O75604 1/20 0.36
MMP2 P08253 1/20 0.36
PIK3CA P42336 2/20 0.36
TTK P33981 5/20 0.36
SYK P43405 1/20 0.35
P2RX7 Q99572 4/20 0.34
DCLK1 O15075 1/20 0.34
ULK1 O75385 1/20 0.34
ALK Q9UM73 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
SCHEMBL24865754 0.78 LRRK2 (0.32) LRRK2PSMD14USP2MMP2P2RX7
SCHEMBL24865751 0.71 FGFR3 (0.39) LRRK2
SCHEMBL24865829 0.69 CSF1R (0.35) PSMD14USP2MMP2P2RX7
SCHEMBL30336250 0.69 TRPV1 (0.47) LRRK2PIK3CATTKDCLK1
SCHEMBL24864913 0.69 TRPV1 (0.47) LRRK2PIK3CATTKDCLK1
SCHEMBL24865544 0.67 BCL6 (0.35) LRRK2ALK
SCHEMBL24864955 0.66 KDM4E (0.36) LRRK2SYKALK
SCHEMBL24865761 0.63 JAK2 (0.33) LRRK2SYK
SCHEMBL30336418 0.61 TRPV1 (0.47) LRRK2PIK3CADCLK1
SCHEMBL30336228 0.61 TRPV1 (0.53)

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