SCHEMBL8997420

SCHEMBL8997420

O=C1CC(OC(=O)c2cc[c]cc2)C(=O)N1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.35
DDB1 Q16531 5/20 0.33
CRBN Q96SW2 5/20 0.33
GAA P10253 1/20 0.33
POLB P06746 1/20 0.33
GPR39 O43194 1/20 0.32
TP53 P04637 1/20 0.32
MAPK1 P28482 1/20 0.32
CHRNA7 P36544 1/20 0.31
CYP19A1 P11511 1/20 0.31
MAP3K14 Q99558 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31

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
SCHEMBL5320949 0.89 HTT (0.42) HTTDDB1CRBNGAAPOLB
SCHEMBL1068302 0.84 GAA (0.48) DDB1CRBNGAACHRNA7LMNA
Ammonia Solution, Strong SCHEMBL9774304 0.83 GAA (0.47) DDB1CRBNGAACHRNA7LMNA
SCHEMBL6510960 0.79 ALDH1A1 (0.45) HTTDDB1CRBNGAAPOLB
SCHEMBL660307 0.78 GAA (0.43) DDB1CRBNGAACHRNA7LMNA
SCHEMBL9838641 0.77 PTPN2 (0.53) CRBNPOLBMAPK1MAPTPKM
SCHEMBL3675740 0.74 ALDH1A1 (0.48) GAALMNAMAPT
SCHEMBL3949247 0.71 MAP3K14 (0.40) DDB1CRBNGAACYP19A1MAP3K14
SCHEMBL7264550 0.71 MAP3K14 (0.40) DDB1CRBNGAACYP19A1MAP3K14
SCHEMBL5956001 0.70 MGLL (0.42) HTTGAAMAPK1MAPTPKM

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-0729030-A1 Chemiluminescence method KYOTO DAIICHI KAGAKU CO., LTD. (JP) 1996-08-28 EP disclosed