SCHEMBL23329861

SCHEMBL23329861

COC(=O)C12CCCC(C1)C(CO)CC2

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
NPSR1 Q6W5P4 1/20 0.31
MAPT P10636 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
SCHEMBL7383277 0.81 CYP4F2 (0.33) CYP4F2CYP4A11NPSR1MAPT
SCHEMBL25747292 0.78 GAA (0.33)
SCHEMBL19189061 0.77 SLC6A12 (0.34) NPSR1MAPT
SCHEMBL25074421 0.76 EPHX1 (0.33) NPSR1MAPT
SCHEMBL22353633 0.75 DPP4 (0.30) NPSR1MAPT
SCHEMBL23329860 0.74 POLB (0.43) NPSR1
SCHEMBL9951753 0.73 NPSR1 (0.38) CYP4F2CYP4A11NPSR1MAPT
SCHEMBL22824391 0.71 KCNA3 (0.31)
SCHEMBL14299766 0.71 PKM (0.39)
SCHEMBL3704482 0.69 ALDH1A1 (0.42) NPSR1MAPT

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-2021083209-A1 SSAO INHIBITORS AND USE THEREOF ECCOGENE (SHANGHAI) CO., LTD. (CN) 2021-05-06 WO disclosed