SCHEMBL28512918

SCHEMBL28512918

CCCCCC(OC(=O)OOC(=O)O)(C(C)(C)C)C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FDPS P14324 11/20 0.34
GGPS1 O95749 7/20 0.34
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CES2 O00748 1/20 0.33
LPAR1 Q92633 1/20 0.33
LPAR3 Q9UBY5 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
SCHEMBL28906743 0.80
SCHEMBL28473661 0.79 MEN1 (0.38) MEN1MAPTKMT2AATML3MBTL1
SCHEMBL4532517 0.78 FDPS (0.34) FDPSGGPS1MEN1MAPTKMT2A
SCHEMBL2125404 0.78 MEN1 (0.34) FDPSGGPS1MEN1MAPTKMT2A
SCHEMBL3707762 0.75 MEN1 (0.36) FDPSGGPS1MEN1MAPTKMT2A
SCHEMBL11238559 0.73 LMNA (0.33)
SCHEMBL8996750 0.72 ALDH1A1 (0.33)
SCHEMBL28757052 0.72 LMNA (0.32)
SCHEMBL11307495 0.71 ALDH1A1 (0.34) ATM
Dodecane SCHEMBL5830464 0.71 GPR84 (0.55) MEN1MAPTKMT2ACES2

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-112334500-A Acrylic copolymer and rubber material 株式会社大阪曹達 2021-02-05 CN disclosed