SCHEMBL24890923

SCHEMBL24890923

CC(C)(C)OC(=O)N(CC1CC1)C1CC1c1ccc(Br)cc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 4/20 0.48
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
EZH2 Q15910 3/20 0.42
MAOA P21397 1/20 0.40
EZH1 Q92800 1/20 0.40
SLC6A4 P31645 2/20 0.37
SLC6A3 Q01959 2/20 0.37
FPR3 P25089 1/20 0.35
FPR2 P25090 1/20 0.35
LSS P48449 1/20 0.35
OPRD1 P41143 1/20 0.35
CNR2 P34972 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
SLC6A2 P23975 1/20 0.34

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
SCHEMBL16394325 0.90 FPR2 (0.44) KDM1AHDAC8HDAC6FPR3FPR2
SCHEMBL16407913 0.90 FPR2 (0.44) KDM1AHDAC8HDAC6FPR3FPR2
SCHEMBL16394326 0.90 FPR2 (0.44) KDM1AHDAC8HDAC6FPR3FPR2
SCHEMBL17002642 0.87 KDM1A (0.45) KDM1AHDAC8HDAC6EZH2MAOA
SCHEMBL24890945 0.87 KDM1A (0.52) KDM1AHDAC8HDAC6EZH2MAOA
SCHEMBL17002639 0.87 KDM1A (0.45) KDM1AHDAC8HDAC6EZH2MAOA
SCHEMBL24890925 0.85 KDM1A (0.43) KDM1AHDAC8HDAC6EZH2MAOA
SCHEMBL17003247 0.85 KDM1A (0.48) KDM1AHDAC8HDAC6EZH2MAOA
SCHEMBL17003245 0.85 KDM1A (0.48) KDM1AHDAC8HDAC6EZH2MAOA
SCHEMBL15789339 0.84 KDM1A (0.45) KDM1AHDAC8HDAC6EZH2MAOA

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-2023284651-A1 N-(2-AMINOPHENYL)BENZAMIDE COMPOUND AND APPLICATION THEREOF 南京明德新药研发有限公司 2023-01-19 WO disclosed