SCHEMBL28787185

SCHEMBL28787185

CCC(C)C(=O)NC(=O)NC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.37
HSD17B10 Q99714 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA14 Q9ULX7 1/20 0.35
KMT2A Q03164 2/20 0.34
TSHR P16473 2/20 0.34
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 1/20 0.34
GLS O94925 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
FOLH1 Q04609 2/20 0.33
NAALAD2 Q9Y3Q0 2/20 0.33
USP2 O75604 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
GAA P10253 1/20 0.33
ALDH1A1 P00352 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL5861940 0.83 HSD17B10 (0.41) LMNAHSD17B10CA1CA2CA7
SCHEMBL3686870 0.80
SCHEMBL8471198 0.80
SCHEMBL103243 0.80
SCHEMBL13040562 0.76 HSD17B10 (0.38) LMNAHSD17B10CA1CA2CA7
SCHEMBL6023207 0.76 HSD17B10 (0.38) HSD17B10CA1CA2CA7CA14
SCHEMBL24131977 0.74 CYP2C9 (0.41) HSD17B10CA1CA2CA7CA14
SCHEMBL3653427 0.74 CRBN (0.40) HSD17B10CA1CA2CA7CA14
SCHEMBL12016957 0.71
SCHEMBL17920013 0.71 SLC15A1 (0.44) LMNAGAAALDH1A1

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-114727959-A Modification of plant messenger packages with charged lipids 旗舰创业创新六公司 2022-07-08 CN disclosed