SCHEMBL9324923

SCHEMBL9324923

CCCCCCCCCCCCCCCCCCOC(=O)OC1C[C@H]2CCC[C@H]2N1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 3/20 0.38
AKT2 P31751 3/20 0.38
AKT3 Q9Y243 3/20 0.38
NAAA Q02083 5/20 0.36
EPHX1 P07099 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
TSHR P16473 2/20 0.34
GAA P10253 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PIK3R1 P27986 1/20 0.33
PIK3CA P42336 1/20 0.33
EPHX2 P34913 1/20 0.33

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
SCHEMBL9335755 0.84 CHRM2 (0.39) CHRM2CHRM4CHRM1CHRM3
SCHEMBL10589156 0.84 CHRM2 (0.39) CHRM2CHRM4CHRM1CHRM3
SCHEMBL9591880 0.79 EPHX2 (0.39) NAAAEPHX1TSHRGAAMAPK1
SCHEMBL9591882 0.79 EPHX2 (0.39) NAAAEPHX1TSHRGAAMAPK1
SCHEMBL9334436 0.76 CHRM2 (0.41) CHRM2CHRM4CHRM1CHRM3
SCHEMBL6448360 0.75 NAAA (0.49) AKT1AKT2AKT3NAAAEPHX1
SCHEMBL6442745 0.75 NAAA (0.49) AKT1AKT2AKT3NAAAEPHX1
SCHEMBL6448630 0.75 NAAA (0.49) AKT1AKT2AKT3NAAAEPHX1
SCHEMBL6445738 0.75 NAAA (0.49) AKT1AKT2AKT3NAAAEPHX1
SCHEMBL5549604 0.75 EPHX2 (0.37) NAAAEPHX1EPHX2

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-0243645-B1 Compounds having a nootropic activity, agents containing them and their use in the treatment and prophylaxis of cognitive malfunctions HOECHST AG (DE) 1994-03-16 EP disclosed