SCHEMBL22475427

SCHEMBL22475427

CC(=O)OC1CCOC[C@H]1OC(C)=O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 5/20 0.40
CHRM1 P11229 3/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
CYP2D6 P10635 1/20 0.40
CHRM4 P08173 2/20 0.37
CHRM3 P20309 2/20 0.37
TSHR P16473 1/20 0.32
BCHE P06276 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
PIK3CD O00329 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
SCHEMBL23982861 1.00 CHRM2 (0.40) CHRM2CHRM1KMT2AMEN1CYP2D6
SCHEMBL25666112 1.00 CHRM2 (0.40) CHRM2CHRM1KMT2AMEN1CYP2D6
SCHEMBL7912588 1.00 CHRM2 (0.40) CHRM2CHRM1KMT2AMEN1CYP2D6
SCHEMBL2627321 1.00 CHRM2 (0.40) CHRM2CHRM1KMT2AMEN1CYP2D6
SCHEMBL20419315 1.00 CHRM2 (0.40) CHRM2CHRM1KMT2AMEN1CYP2D6
SCHEMBL10440862 0.84 CHRM2 (0.42) CHRM2CHRM1KMT2AMEN1CYP2D6
SCHEMBL24260319 0.84 CHRM2 (0.38) CHRM2CHRM1KMT2AMEN1CYP2D6
SCHEMBL24752327 0.84 CHRM2 (0.38) CHRM2CHRM1KMT2AMEN1CYP2D6
SCHEMBL17294429 0.84 CHRM2 (0.38) CHRM2CHRM1KMT2AMEN1CYP2D6
SCHEMBL24792569 0.84 CHRM2 (0.38) CHRM2CHRM1KMT2AMEN1CYP2D6

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
EP-3489236-B1 PROCESS FOR THE PREPARATION OF FUSED HETEROAROMATIC PYRROLIDINONES TAKEDA PHARMACEUTICALS CO (JP) 2020-09-30 EP disclosed