SCHEMBL21052188

SCHEMBL21052188

CCc1csc(B2OC(C)(C)C(C)(C)O2)c1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ LPL P06858 9/20 0.39
▸ LIPG Q9Y5X9 9/20 0.39
▸ F11 P03951 1/20 0.31
▸ HIF1A Q16665 1/20 0.31
▸ P2RX7 Q99572 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
SCHEMBL12913268 0.83 LPL (0.49) LPLLIPG
SCHEMBL9891143 0.82 LPL (0.55) LPLLIPG
SCHEMBL15072065 0.81 LPL (0.56) LPLLIPGHIF1A
SCHEMBL31516134 0.81 LPL (0.56) LPLLIPGHIF1A
SCHEMBL121471 0.81 LPL (0.56) LPLLIPGHIF1A
SCHEMBL25049186 0.79 LIPG (0.39) LPLLIPGF11
SCHEMBL12913231 0.77 LIPG (0.45) LPLLIPG
SCHEMBL25280699 0.76 LPL (0.36) LPLLIPG
SCHEMBL18966974 0.76 LPL (0.41) LPLLIPG
SCHEMBL19176431 0.76 LPL (0.41) LPLLIPG

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3720852-A1 FLUOROPHENYL SUBSTITUTED MUSCARINIC RECEPTOR LIGANDS WITH SELECTIVITY FOR M3 OVER M2 Friedrich-Alexander-Universität Erlangen-Nürnberg (DE) 2020-10-14 — — EP disclosed
WO-2019110521-A1 FLUOROPHENYL SUBSTITUTED MUSCARINIC RECEPTOR LIGANDS WITH SELECTIVITY FOR M3 OVER M2 Friedrich-Alexander-Universität Erlangen-Nürnberg (DE) 2019-06-13 — — WO disclosed
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