SCHEMBL24220501

SCHEMBL24220501

CN(C)CCCOC(=O)N1CCN(c2ccc(Cl)cc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.54
▸ LMNA P02545 4/20 0.51
▸ MAPT P10636 3/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.51
▸ HTT P42858 3/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ HRH3 Q9Y5N1 1/20 0.50
▸ AKR1C3 P42330 4/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ HPGD P15428 1/20 0.47
▸ ADRB2 P07550 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ CHIA Q9BZP6 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL3049784 0.80 GFER (0.55) GAALMNAMAPTKDM4ETSHR
SCHEMBL314250 0.78 HTR1A (0.54) GAALMNAMAPTKDM4ETSHR
SCHEMBL3048329 0.76 MAPT (0.73) LMNAMAPTL3MBTL1HTTMAPK1
SCHEMBL5232354 0.74 FAAH (0.61) GAALMNAMAPTKDM4EL3MBTL1
SCHEMBL10401849 0.74 CHRM4 (0.54) LMNAMAPTKDM4EHTTHRH3
SCHEMBL5539971 0.74 MAPT (0.76) GAALMNAMAPTKDM4ETSHR
SCHEMBL5539965 0.74 MAPT (0.59) GAALMNAMAPTKDM4ETSHR
SCHEMBL3313011 0.73 MAPT (0.58) GAALMNAMAPTKDM4EL3MBTL1
SCHEMBL5541814 0.73 MAPT (0.74) GAALMNAMAPTKDM4ETSHR
SCHEMBL5541807 0.73 MAPT (0.58) GAALMNAMAPTKDM4ETSHR

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-3562824-B1 OXAZOLE DERIVATIVES FOR USE IN THE TREATMENT OF CANCER LIFEARC (GB) 2022-01-26 — — EP disclosed
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