SCHEMBL27740239

SCHEMBL27740239

[CH2]C(O)C(C)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC22A2 O15244 1/20 0.48
SLC47A1 Q96FL8 1/20 0.48
MAPT P10636 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.42
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 0.41
EPHX2 P34913 5/20 0.38
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
GRIN3A Q8TCU5 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
GAA P10253 1/20 0.34
DPP4 P27487 1/20 0.34
P2RX7 Q99572 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
SCHEMBL40513 0.75 SLC22A2 (0.56) SLC22A2SLC47A1MAPTSMN1; SMN2NPC1
SCHEMBL182779 0.75 SLC22A2 (0.56) SLC22A2SLC47A1MAPTSMN1; SMN2NPC1
SCHEMBL27514830 0.75 SLC22A2 (0.44) SLC22A2SLC47A1MAPTSMN1; SMN2NPC1
SCHEMBL23111396 0.72 SLC22A2 (0.50) SLC22A2SLC47A1MAPTSMN1; SMN2NPC1
SCHEMBL19758138 0.71 SMN1; SMN2 (0.53) SLC22A2SLC47A1MAPTSMN1; SMN2NPC1
SCHEMBL2961008 0.71 SMN1; SMN2 (0.53) SLC22A2SLC47A1MAPTSMN1; SMN2NPC1
SCHEMBL20042206 0.71 SMN1; SMN2 (0.53) SLC22A2SLC47A1MAPTSMN1; SMN2NPC1
Acrylic Acid SCHEMBL11261108 0.70 NPC1 (0.43) SLC22A2SLC47A1MAPTSMN1; SMN2NPC1
SCHEMBL18281706 0.70 NPC1 (0.47) SLC22A2SLC47A1MAPTSMN1; SMN2NPC1
SCHEMBL4027679 0.69 SLC22A2 (0.48) SLC22A2SLC47A1MAPTSMN1; SMN2NPC1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102066439-B Monomer containing lactone skeleton, polymer compound and photoresist composition DAICEL CHEM 2013-08-07 CN disclosed
CN-101959909-B Monomer containing electron-withdrawing substituent and lactone skeleton, polymer compound and photoresist composition DAICEL CHEM 2013-03-13 CN disclosed
CN-101273025-B Cyano-containing polycyclic esters having lactone skeletons DAICEL CHEM 2012-05-09 CN disclosed
CN-102066439-A Monomer containing lactone skeleton, polymer compound and photoresist composition DAICEL CHEM 2011-05-18 CN disclosed
CN-101959909-A Monomer containing electron-withdrawing substituent and lactone skeleton, polymer compound and photoresist composition DAICEL CHEM 2011-01-26 CN disclosed
CN-101273025-A Cyano-containing polycyclic esters having lactone skeletons DAICEL CHEM (JP) 2008-09-24 CN disclosed