SCHEMBL26115263

SCHEMBL26115263

CC(C)(C)OC(=O)N1CC(N)Cc2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.51
BCHE P06276 1/20 0.43
NAMPT P43490 1/20 0.43
NOTUM Q6P988 2/20 0.42
MAPK1 P28482 1/20 0.40
HDAC1 Q13547 2/20 0.40
HDAC6 Q9UBN7 2/20 0.40
SLC6A2 P23975 2/20 0.39
SLC6A4 P31645 2/20 0.39
SLC6A3 Q01959 2/20 0.39
AADAT Q8N5Z0 2/20 0.39
GOT1 P17174 1/20 0.39
KYAT1 Q16773 1/20 0.39
KYAT3 Q6YP21 1/20 0.39
GPR119 Q8TDV5 1/20 0.39

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
SCHEMBL30632531 1.00 KDM1A (0.51) KDM1ABCHENAMPTNOTUMMAPK1
SCHEMBL16385108 0.84 NOTUM (0.47) KDM1ABCHENAMPTNOTUMMAPK1
SCHEMBL16353535 0.84 NOTUM (0.47) KDM1ABCHENAMPTNOTUMMAPK1
SCHEMBL16353667 0.84 NOTUM (0.47) KDM1ABCHENAMPTNOTUMMAPK1
SCHEMBL14587287 0.84 KDM1A (0.46) KDM1ABCHENAMPTNOTUMMAPK1
SCHEMBL14587286 0.84 KDM1A (0.46) KDM1ABCHENAMPTNOTUMMAPK1
SCHEMBL6648174 0.84 NOTUM (0.47) KDM1ABCHENAMPTNOTUMMAPK1
SCHEMBL7633049 0.82 MCL1 (0.46) KDM1ABCHENAMPTNOTUMMAPK1
SCHEMBL12376485 0.81 KDM1A (0.44) KDM1ABCHENAMPTNOTUMMAPK1
SCHEMBL8567308 0.81 NAMPT (0.46) KDM1ABCHENAMPTNOTUMMAPK1

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-2023192375-A1 HSD17B13 INHIBITORS AND USES THEREOF FL2022-001, INC. (US) 2023-10-05 WO disclosed