SCHEMBL20850679

SCHEMBL20850679

CCCCC1C(CCC)OC(=O)N1C

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.35
TP53 P04637 1/20 0.35
GRM2 Q14416 5/20 0.35
KAT2A Q92830 2/20 0.33
PLA2G6 O60733 2/20 0.32
PLA2G4A P47712 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
CYP1A2 P05177 2/20 0.31
ABCB1 P08183 1/20 0.31
ABL1 P00519 1/20 0.30
RIN1 Q13671 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL20850745 0.95 CYP1A2 (0.37) GAATP53GRM2PLA2G6PLA2G4A
SCHEMBL23841969 0.93 CYP1A2 (0.39) GRM2CYP1A2
SCHEMBL20470608 0.89 GRM2 (0.38) GAATP53GRM2NPC1RAB9A
SCHEMBL23845211 0.84 GRM2 (0.39) GRM2CYP1A2
SCHEMBL20850698 0.80 TP53 (0.36) GAATP53GRM2CYP1A2ABCB1
SCHEMBL24846890 0.79 KDM4E (0.30)
SCHEMBL20850730 0.74 CYP1A2 (0.30) CYP1A2
SCHEMBL20643385 0.66 POLB (0.37) GRM2CYP1A2
SCHEMBL23744393 0.64 GAA (0.35) GAATP53ABL1RIN1TDP1
SCHEMBL818514 0.63

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