SCHEMBL28375340

SCHEMBL28375340

CCCc1ccccc1C1(CCC)OC(=O)CC(=O)O1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.33
SIGMAR1 Q99720 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
ELANE P08246 1/20 0.31
HDAC4 P56524 1/20 0.30

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
SCHEMBL28375356 0.86 CTRC (0.34) CYP2D6MEN1MAPTKMT2AELANE
SCHEMBL30171122 0.78 CYP2D6 (0.42) CYP2D6SIGMAR1MEN1LMNAMAPT
SCHEMBL1617397 0.78 CYP2D6 (0.42) CYP2D6SIGMAR1MEN1LMNAMAPT
SCHEMBL8123326 0.71 CYP2D6 (0.45) CYP2D6SIGMAR1MEN1LMNAMAPT
SCHEMBL7930725 0.71 MMP2 (0.34) SIGMAR1MEN1KMT2A
SCHEMBL7789544 0.70 CYP2D6 (0.44) CYP2D6SIGMAR1MEN1LMNAMAPT
SCHEMBL28380000 0.70 GABRA1 (0.34) SIGMAR1ELANE
SCHEMBL4190363 0.68 L3MBTL1 (0.41) MEN1LMNAMAPTKMT2A
SCHEMBL14740569 0.67 GABRA1 (0.32) SIGMAR1
SCHEMBL16593853 0.66 HDAC4 (0.39) HDAC4

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-110997795-B High stiffness polypropylene impact copolymers 埃克森美孚化学专利公司 2022-10-04 CN disclosed
CN-110997795-A High stiffness polypropylene impact copolymers 埃克森美孚化学专利公司 2020-04-10 CN disclosed