SCHEMBL28842147

SCHEMBL28842147

CC(C)(C)OC(=O)C1C=CC=CN1C(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.34
HPGD P15428 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
USP30 Q70CQ3 1/20 0.32
PTPN2 P17706 1/20 0.32
PTPN1 P18031 1/20 0.32
PTPN6 P29350 1/20 0.32
RECQL P46063 1/20 0.32
CTSK P43235 1/20 0.32
USP2 O75604 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
BCHE P06276 1/20 0.31
MAPK1 P28482 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
SCHEMBL27721708 0.90 PDE4B (0.36) NR1H2HPGDCHRM2CHRM1CHRM3
SCHEMBL4772238 0.86 KMT2A (0.38) NR1H2HPGDKMT2AMEN1RECQL
SCHEMBL28556370 0.80 NR1H2 (0.33) NR1H2ABCB1
SCHEMBL28428311 0.79 CHRM2 (0.39) NR1H2HPGDCHRM2CHRM1CHRM3
SCHEMBL28107442 0.79 USP2 (0.37) NR1H2HPGDCHRM2CHRM1CHRM3
SCHEMBL30121408 0.77 CHRM2 (0.34) NR1H2HPGDCHRM2CHRM1CHRM3
SCHEMBL19892750 0.77 CHRM2 (0.34) NR1H2HPGDCHRM2CHRM1CHRM3
SCHEMBL27510719 0.73 CTSK (0.33) NR1H2CHRM2CHRM1CHRM3KMT2A
SCHEMBL28102330 0.72 LMNA (0.36) NR1H2CHRM2CHRM1CHRM3KMT2A
SCHEMBL20545175 0.71 DPP4 (0.31)

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
CN-115103709-A MASP-2 inhibitors and methods of use 奥默罗斯公司 2022-09-23 CN disclosed