SCHEMBL25898943

SCHEMBL25898943

CC(C)(C)OC(=O)N1CCC(=O)C(Sc2ccccc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 7/20 0.53
KDM4E B2RXH2 2/20 0.48
PKM P14618 1/20 0.48
STS P08842 1/20 0.46
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
THRB P10828 2/20 0.44
GAA P10253 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAPT P10636 1/20 0.44
PTPN2 P17706 1/20 0.44
PTPN1 P18031 1/20 0.44
PTPN6 P29350 1/20 0.44

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
SCHEMBL15769716 0.88 GPR119 (0.47) GPR119KDM4ETHRBMAPTPTPN2
SCHEMBL25899021 0.87 HPGDS (0.47) GPR119KDM4EMEN1KMT2ATHRB
SCHEMBL15769506 0.87 GPR119 (0.43) GPR119KDM4ESTSTHRBMAPT
SCHEMBL25898980 0.86 MEN1 (0.48) GPR119KDM4ESTSMEN1KMT2A
SCHEMBL3128872 0.83 GPR119 (0.61) GPR119KDM4EPKMSTSMEN1
SCHEMBL25899063 0.83 GPR119 (0.45) GPR119KDM4EMEN1KMT2ATHRB
SCHEMBL25898944 0.82 USP30 (0.44) GPR119KDM4EPKM
SCHEMBL15781353 0.78 RORC (0.44) GPR119
SCHEMBL15781360 0.78 GPR119 (0.46) GPR119KDM4ETHRBMAPTPTPN2
SCHEMBL13060401 0.77 HPGD (0.60) GPR119KDM4EPKMSTSMEN1

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-2023114858-A1 BENZOFURAN AND BENZOTHIOPHENE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. (US) 2023-06-22 WO disclosed