SCHEMBL28518217

SCHEMBL28518217

CCCCCC=CCC=CCC=CCC=CCCCC(=O)ON1CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.58
CNR1 P21554 4/20 0.57
ALDH1A1 P00352 3/20 0.57
MAPT P10636 3/20 0.57
FAAH O00519 3/20 0.57
HPGD P15428 2/20 0.57
CNR2 P34972 2/20 0.57
THRB P10828 1/20 0.57
PPARG P37231 3/20 0.57
PPARD Q03181 2/20 0.57
PPARA Q07869 2/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
KDM4E B2RXH2 1/20 0.57
MEN1 O00255 1/20 0.57
USP2 O75604 1/20 0.57
LMNA P02545 1/20 0.57
TP53 P04637 1/20 0.57
CYP3A4 P08684 1/20 0.57
HSPD1 P10809 1/20 0.57
CYP19A1 P11511 1/20 0.57

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
SCHEMBL28907757 0.95 ALDH1A1 (0.58) MGLLALDH1A1HPGDPPARGPPARD
SCHEMBL5875143 0.93 MGLL (0.55) MGLLCNR1ALDH1A1MAPTFAAH
SCHEMBL28526154 0.91 TERT (0.54) MAPTFAAHCNR2PPARGPPARD
SCHEMBL5875440 0.90 CNR1 (0.54) MGLLCNR1ALDH1A1MAPTFAAH
SCHEMBL5875012 0.89 ALDH1A1 (0.54) MGLLALDH1A1HPGDPPARGPPARD
SCHEMBL28520277 0.87 ALDH1A1 (0.64) ALDH1A1MAPTHPGDPPARGPPARD
SCHEMBL5874706 0.86 ALDH1A1 (0.51) MGLLCNR1ALDH1A1MAPTHPGD
SCHEMBL324335 0.86 ALDH1A1 (0.51) CNR1ALDH1A1MAPTFAAHHPGD
SCHEMBL5874325 0.84 TERT (0.50) MAPTFAAHPPARGPPARDPPARA
SCHEMBL324745 0.81 CNR1 (0.51) CNR1MAPTFAAHPPARGPPARD

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-112220929-A Nano-drug carrier, nano-drug preparation, preparation method and application 湖北大学 2021-01-15 CN disclosed