SCHEMBL20850698

SCHEMBL20850698

CCCCC1C(C)OC(=O)N1C

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.36
GAA P10253 2/20 0.36
GRM2 Q14416 5/20 0.36
CYP1A2 P05177 2/20 0.32
PPARG P37231 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
ABCB1 P08183 1/20 0.31
HTT P42858 1/20 0.31
ABL1 P00519 1/20 0.31
RIN1 Q13671 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL20470608 0.80 GRM2 (0.38) TP53GAAGRM2ABCB1
SCHEMBL20850679 0.80 GAA (0.35) TP53GAAGRM2CYP1A2ABCB1
SCHEMBL20850745 0.75 CYP1A2 (0.37) TP53GAAGRM2CYP1A2
SCHEMBL23845211 0.75 GRM2 (0.39) GRM2CYP1A2
SCHEMBL16985222 0.75
SCHEMBL23841969 0.74 CYP1A2 (0.39) GRM2CYP1A2
SCHEMBL19393170 0.74 ABCB1 (0.38) TP53GAAGRM2MEN1KMT2A
SCHEMBL6553099 0.73 GAA (0.43) TP53GAAPPARGABL1RIN1
SCHEMBL818514 0.69
SCHEMBL13764867 0.66

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-2019060742-A1 PROTEIN DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC (US) 2019-03-28 WO disclosed