SCHEMBL9803238

SCHEMBL9803238

CCOC(=O)[C@H]1[C@H](c2ccc(F)cc2)CC(=O)N1C(C)C

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.39
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
SLC6A3 Q01959 3/20 0.38
HTR7 P34969 3/20 0.38
SLC18A2 Q05940 3/20 0.38
HTR2A P28223 2/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA4 P22748 1/20 0.38
CA7 P43166 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL9803344 1.00 HRH3 (0.39) HRH3LMNAPOLBSLC6A3HTR7
SCHEMBL9803337 1.00 HRH3 (0.39) HRH3LMNAPOLBSLC6A3HTR7
SCHEMBL9803258 1.00 HRH3 (0.39) HRH3LMNAPOLBSLC6A3HTR7
SCHEMBL9803245 1.00 HRH3 (0.39) HRH3LMNAPOLBSLC6A3HTR7
SCHEMBL24817538 0.77 SLC6A3 (0.42) LMNAPOLBSLC6A3SLC18A2HTR2A
SCHEMBL16055484 0.75 NPC1 (0.41) LMNASLC6A3HTR7SLC18A2HTR2A
SCHEMBL3924677 0.75 L3MBTL1 (0.43) LMNASLC6A3SLC18A2HTR2A
SCHEMBL3924679 0.75 L3MBTL1 (0.43) LMNASLC6A3SLC18A2HTR2A
SCHEMBL12538444 0.75 L3MBTL1 (0.43) LMNASLC6A3SLC18A2HTR2A
SCHEMBL17525816 0.73 L3MBTL1 (0.43) LMNAHTR7MAPT

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
US-5049577-A 2-pyrrolidone substituted dihydroxy alkanoic, alkenoic and alkynoic acids, compositions and HMG-CoA reductase inhibition therewith E. R. SQUIBB & SONS, INC. (US) 1991-09-17 US disclosed