SCHEMBL28637253

SCHEMBL28637253

CCOC(=O)C(CC(C)C)=NO

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 1/20 0.46
APOBEC3G Q9HC16 1/20 0.46
MAPT P10636 1/20 0.36
ALDH1A1 P00352 4/20 0.36
NPSR1 Q6W5P4 1/20 0.35
GLO1 Q04760 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
LMNA P02545 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TSHR P16473 1/20 0.34
ALOX15 P16050 1/20 0.33
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
SOAT1 P35610 1/20 0.33
MMP8 P22894 1/20 0.33
CA2 P00918 1/20 0.32

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
SCHEMBL7634040 0.81 APOBEC3A (0.51) APOBEC3AAPOBEC3GMAPTALDH1A1NPSR1
SCHEMBL11417638 0.79 ALDH1A1 (0.37) ALDH1A1TDP1MGAMGAASI
SCHEMBL11417640 0.79 ALDH1A1 (0.37) ALDH1A1TDP1MGAMGAASI
SCHEMBL5612048 0.79 ALDH1A1 (0.42) MAPTALDH1A1NPSR1GLO1TDP1
SCHEMBL5612037 0.79 ALDH1A1 (0.42) MAPTALDH1A1NPSR1GLO1TDP1
SCHEMBL26325159 0.79 APOBEC3A (0.51) APOBEC3AAPOBEC3GMAPTALDH1A1NPSR1
SCHEMBL28622235 0.79 APOBEC3A (0.51) APOBEC3AAPOBEC3GMAPTALDH1A1NPSR1
SCHEMBL7634890 0.78 APOBEC3A (0.56) APOBEC3AAPOBEC3GMAPTNPSR1GLO1
SCHEMBL26422721 0.77 MAPT (0.35) APOBEC3AAPOBEC3GMAPTALDH1A1NPSR1
SCHEMBL7644872 0.77 APOBEC3A (0.55) APOBEC3AAPOBEC3GMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113286795-B Imidazo [1,2-b ] pyridazine IL-17A inhibitors 伊莱利利公司 2023-11-03 CN disclosed
CN-113286795-A Imidazo [1,2-b ] pyridazine IL-17A inhibitors 伊莱利利公司 2021-08-20 CN disclosed