SCHEMBL29610235

SCHEMBL29610235

COC(=O)CC1=C(CC(=O)OC)N1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.48
TSHR P16473 5/20 0.46
HSP90AB1 P08238 1/20 0.45
CYP4F2 P78329 1/20 0.42
CYP4A11 Q02928 1/20 0.42
HSD17B10 Q99714 4/20 0.42
GAA P10253 3/20 0.42
MGAM O43451 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
MAPT P10636 3/20 0.40
HTT P42858 2/20 0.39
ALDH1A1 P00352 3/20 0.37
GFER P55789 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
KMT2A Q03164 1/20 0.37
EGFR P00533 1/20 0.36

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
SCHEMBL8488117 0.70 HSP90AB1 (0.47) TP53TSHRHSP90AB1CYP4F2CYP4A11
SCHEMBL14354674 0.68 HSP90AB1 (0.56) TSHRHSP90AB1CYP4F2CYP4A11HSD17B10
SCHEMBL21891794 0.68 HSP90AB1 (0.75) TP53TSHRHSP90AB1CYP4F2CYP4A11
SCHEMBL4113212 0.68 CYP4F2 (0.76) TP53HSP90AB1CYP4F2CYP4A11GAA
SCHEMBL12709145 0.67 TSHR (0.43) TP53TSHRHSP90AB1CYP4F2CYP4A11
SCHEMBL12042064 0.67 CYP4F2 (0.45) TP53TSHRHSP90AB1CYP4F2CYP4A11
SCHEMBL53913 0.66
SCHEMBL3441102 0.66 MGAM (0.69) TP53TSHRHSP90AB1HSD17B10GAA
SCHEMBL140582 0.65
SCHEMBL10916991 0.65 CYP4F2 (0.44) TP53TSHRHSP90AB1CYP4F2CYP4A11

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4208509-A1 CROSS-LINKABLE COMPOSITIONS BASED ON ORGANOSILICON COMPOUNDS Wacker Chemie AG (DE) 2023-07-12 EP disclosed
WO-2022089733-A1 CROSS-LINKABLE COMPOSITIONS ON THE BASIS OF ORGANOSILICON COMPOUNDS WACKER CHEMIE AG (DE) 2022-05-05 WO disclosed
WO-2022048730-A1 CROSS-LINKABLE COMPOSITIONS BASED ON ORGANOSILICON COMPOUNDS WACKER CHEMIE AG (DE) 2022-03-10 WO disclosed