SCHEMBL28291057

SCHEMBL28291057

COC(=O)CC(C(C)C)C(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 3/20 0.47
TSHR P16473 4/20 0.46
HSD17B10 Q99714 2/20 0.42
MGAM O43451 1/20 0.42
GAA P10253 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.37
MAPT P10636 2/20 0.37
RAB9A P51151 1/20 0.37
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP3 P08254 1/20 0.35
MMP9 P14780 1/20 0.35
MMP13 P45452 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
TET2 Q6N021 1/20 0.34
MEN1 O00255 1/20 0.34

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
SCHEMBL17124705 0.86 TSHR (0.40) PRKCATSHRHSD17B10MGAMGAA
SCHEMBL9908330 0.79 TSHR (0.46) TSHRHSD17B10MGAMGAASI
SCHEMBL5077875 0.78 TSHR (0.50) TSHRHSD17B10MGAMGAASI
SCHEMBL112862 0.78
SCHEMBL5081302 0.78 TSHR (0.50) TSHRHSD17B10MGAMGAASI
SCHEMBL265822 0.78 TSHR (0.50) TSHRHSD17B10MGAMGAASI
SCHEMBL9078516 0.77 TSHR (0.43) TSHRHSD17B10MGAMGAASI
SCHEMBL7758860 0.77 PRKCA (0.46) PRKCAMMP1MMP2MMP3MMP9
SCHEMBL7378346 0.77 TSHR (0.43) TSHRHSD17B10MGAMGAASI
SCHEMBL8232980 0.77 TSHR (0.41) PRKCATSHRHSD17B10MGAMGAA

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-109810589-A Light converts resin combination, light conversion layer folds substrate and image display device 东友精细化工有限公司 2019-05-28 CN disclosed