SCHEMBL28700718

SCHEMBL28700718

CC(C)(C)OC(=O)N(CC1CCN(C(=O)O)CC1)C1CC1c1ccc(C2CC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.43
KDM1A O60341 7/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
EZH2 Q15910 3/20 0.38
MAOA P21397 1/20 0.38
EZH1 Q92800 1/20 0.38
HSD11B1 P28845 1/20 0.37
KDM4E B2RXH2 1/20 0.36
PKM P14618 1/20 0.36
NAMPT P43490 1/20 0.36
LIMK2 P53671 1/20 0.35
MAOB P27338 1/20 0.35
RORC P51449 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
SCHEMBL16394573 0.92 GPR119 (0.52) GPR119KDM1AHDAC8HDAC6KDM4E
SCHEMBL16394574 0.92 GPR119 (0.52) GPR119KDM1AHDAC8HDAC6KDM4E
SCHEMBL16394326 0.83 FPR2 (0.44) GPR119KDM1AHDAC8HDAC6KDM4E
SCHEMBL16407913 0.83 FPR2 (0.44) GPR119KDM1AHDAC8HDAC6KDM4E
SCHEMBL16394325 0.83 FPR2 (0.44) GPR119KDM1AHDAC8HDAC6KDM4E
SCHEMBL18845512 0.82 KDM1A (0.43) KDM1AHDAC8HDAC6EZH2MAOA
SCHEMBL28767601 0.82 ACHE (0.39) KDM1AHDAC8HDAC6EZH2MAOA
SCHEMBL17002642 0.81 KDM1A (0.45) KDM1AHDAC8HDAC6EZH2MAOA
SCHEMBL17002639 0.81 KDM1A (0.45) KDM1AHDAC8HDAC6EZH2MAOA
SCHEMBL24890923 0.79 KDM1A (0.48) 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
CN-107266345-B (hetero) arylcyclopropylamine compounds as LSD1 inhibitors 奥瑞泽恩基因组学股份有限公司 2021-08-17 CN disclosed