SCHEMBL9688429

SCHEMBL9688429

CC(C)(C)[Si](C)(C)Oc1ccc(CCC(=O)N2CCC(O)C2)cc1O[Si](C)(C)C(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 1/20 0.40
KMT2A Q03164 5/20 0.39
MEN1 O00255 2/20 0.39
GFER P55789 1/20 0.39
DRD2 P14416 1/20 0.39
HPGD P15428 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MMP2 P08253 1/20 0.37
ANPEP P15144 1/20 0.37
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM1 P11229 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
SLC6A4 P31645 1/20 0.37

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
SCHEMBL9687813 0.80 ABCB1 (0.42) DRD2CHRM2CHRM1SLC6A4
SCHEMBL9688424 0.77 POLB (0.40) ALDH1A1SLC6A4RAB9A
SCHEMBL9686539 0.75 DRD2 (0.48) DRD2
SCHEMBL29217928 0.74 DRD2 (0.47) DRD2
SCHEMBL29217925 0.73 DRD2 (0.46) KMT2AMEN1DRD2SMN1; SMN2KDM4E
SCHEMBL12945058 0.71 POLB (0.67) KMT2AGFERHPGDSMN1; SMN2CHRM2
SCHEMBL22068058 0.71 DRD2 (0.45) DRD2KDM4EALDH1A1MAPTMAPK1
SCHEMBL9687111 0.70 DRD2 (0.40) DRD2CHRM2CHRM4CHRM1SLC6A4
SCHEMBL9687809 0.70 MCHR1 (0.34) DRD2L3MBTL1
SCHEMBL19490649 0.69 DRD2 (0.46) KMT2AMEN1DRD2SMN1; SMN2KDM4E

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-0472062-A1 Beta-lactam compounds, and their production and use SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1992-02-26 EP disclosed