SCHEMBL6509410

SCHEMBL6509410

CC(=O)OC1CCC(C(=O)OC(=O)C2CCC(O)CC2)CC1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 5/20 0.32
▸ CHRM1 P11229 3/20 0.32
▸ CHRM4 P08173 2/20 0.32
▸ CHRM5 P08912 2/20 0.32
▸ CHRM3 P20309 2/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ KMT2A Q03164 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
SCHEMBL2267594 0.88 CHRM2 (0.37) CHRM2CHRM1CHRM4CHRM5CHRM3
SCHEMBL14127758 0.88 CHRM2 (0.37) CHRM2CHRM1CHRM4CHRM5CHRM3
SCHEMBL6509408 0.85 PLG (0.35) CHRM2CHRM1CHRM4CHRM5CHRM3
SCHEMBL12158777 0.82 CHRM2 (0.37) CHRM2CHRM1CHRM4CHRM5CHRM3
SCHEMBL14679492 0.81 EPHX2 (0.34) CHRM2CHRM1CHRM4CHRM3MEN1
SCHEMBL10939338 0.80 TP53 (0.43) —
SCHEMBL22054675 0.78 CHRM2 (0.33) CHRM2CHRM1CHRM4CHRM5CHRM3
SCHEMBL177205 0.78 — —
SCHEMBL12476221 0.78 CHRM2 (0.42) CHRM2CHRM1CHRM4CHRM5CHRM3
SCHEMBL13804069 0.77 CHRM2 (0.36) CHRM2CHRM1CHRM4CHRM5CHRM3

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-2005105814-A1 TETRACYCLIC INHIBITORS OF JANUS KINASES INCYTE CORPORATION (US) 2005-11-10 — — WO disclosed
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