SCHEMBL24676843

SCHEMBL24676843

CC(C)(C)OCN1CC(C(=O)O)C1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
S1PR5 Q9H228 14/20 0.38
S1PR1 P21453 14/20 0.38
POLB P06746 1/20 0.37
S1PR3 Q99500 6/20 0.36
S1PR4 O95977 2/20 0.36
SLC6A1 P30531 1/20 0.35

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
SCHEMBL2317708 0.83 SLC6A1 (0.50) SLC6A1
SCHEMBL25351419 0.81 LMNA (0.45) S1PR5
SCHEMBL19724362 0.81 LTA4H (0.31)
SCHEMBL18403339 0.76 MEN1 (0.49)
SCHEMBL19035291 0.75 KDM4E (0.31)
SCHEMBL3953545 0.74 S1PR5 (0.41) S1PR5S1PR1POLBS1PR3S1PR4
SCHEMBL18696474 0.72 NR1H2 (0.39)
SCHEMBL25413199 0.72 S1PR5 (0.34) S1PR5
SCHEMBL25351553 0.72 S1PR5 (0.34) S1PR5
SCHEMBL24654380 0.71 ALDH1A1 (0.32)

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-2022155941-A1 CDK2 INHIBITORS QILU REGOR THERAPEUTICS INC. (CN) 2022-07-28 WO disclosed