SCHEMBL30985155

SCHEMBL30985155

Cc1cc(N)ccc1C1CCC2(CC1)CCN(C(=O)OC(C)(C)C)CC2

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.46
GPR119 Q8TDV5 7/20 0.46
HDAC2 Q92769 2/20 0.41
HDAC1 Q13547 1/20 0.41
KDM1A O60341 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
ACACB O00763 2/20 0.41
NAMPT P43490 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 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
SCHEMBL1159547 0.89 MAPT (0.51) NR1H2GPR119KDM4EMAPTTHRB
SCHEMBL30021635 0.89 MAPT (0.51) NR1H2GPR119KDM4EMAPTTHRB
SCHEMBL30984706 0.83 GPR119 (0.49) NR1H2GPR119MAPTNAMPTALDH1A1
SCHEMBL30962613 0.82 NR1H2 (0.49) NR1H2GPR119KDM4EMAPTTHRB
SCHEMBL30962762 0.81 NR1H2 (0.48) NR1H2KDM4EALDH1A1
SCHEMBL3815448 0.80 MAPT (0.52) NR1H2GPR119KDM4EMAPTTHRB
SCHEMBL23868014 0.79 MGLL (0.53) GPR119MAPTACACBNAMPT
SCHEMBL31443726 0.77 NR1H2 (0.54) NR1H2GPR119KDM4EMAPTTHRB
SCHEMBL31549191 0.76 NR1H2 (0.53) NR1H2GPR119HDAC2HDAC1ACACB
SCHEMBL24629830 0.76 STS (0.50) NR1H2GPR119KDM4EMAPTTHRB

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-2024146502-A1 WEE1 DEGRADING COMPOUNDS BEIJING NEOX BIOTECH LIMITED (CN) 2024-07-11 WO disclosed