SCHEMBL11118063

SCHEMBL11118063

CC(C)C(C(=O)CP(=O)(O)O)C(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.42
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
BLM P54132 1/20 0.42
KMT2A Q03164 1/20 0.42
LAP3 P28838 3/20 0.39
ENO1 P06733 1/20 0.37
PGK1 P00558 1/20 0.36
PGK2 P07205 1/20 0.36
GRIN2D O15399 1/20 0.35
GRIN3B O60391 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
GRIN2B Q13224 1/20 0.35
GRIN2C Q14957 1/20 0.35
GRIN3A Q8TCU5 1/20 0.35
ANPEP P15144 3/20 0.34
ERAP1 Q9NZ08 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
SCHEMBL147193 0.79 TDP1 (0.46) TDP1MEN1LMNAHPGDTSHR
SCHEMBL14617621 0.77 TDP1 (0.43) TDP1MEN1LMNAHPGDTSHR
SCHEMBL25284521 0.75 MMP1 (0.33) TDP1ALDH1A1MMP1MMP8
SCHEMBL263667 0.70 LAP3 (0.42) TDP1MEN1LMNAHPGDTSHR
SCHEMBL2974723 0.67 FDPS (0.57) LAP3
SCHEMBL9003816 0.67 GRIN2D (0.46) TDP1MEN1LMNAHPGDTSHR
SCHEMBL7941318 0.67 BLM (0.47) TDP1MEN1LMNAHPGDTSHR
SCHEMBL2994534 0.67 FDPS (0.50) TDP1MEN1LMNAHPGDTSHR
SCHEMBL28728326 0.67 MEN1 (0.43) TDP1MEN1LMNAHPGDTSHR
SCHEMBL7836561 0.65 MEN1 (0.37) TDP1MEN1LMNAHPGDTSHR

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
EP-0121117-A1 Derivatives of dihydropyridine and production thereof NIPPON SHINYAKU COMPANY, LIMITED (JP) 1984-10-10 EP disclosed