SCHEMBL7260646

SCHEMBL7260646

NN1CCCCC1OC(=O)O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
POLB P06746 1/20 0.30
HSD11B1 P28845 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
SCHEMBL7261140 0.94 POLB (0.31) SMN1; SMN2POLB
SCHEMBL25440282 0.78 HSD11B1 (0.31) ALDH1A1HSD11B1
SCHEMBL7261167 0.78 ATM (0.33) ALDH1A1MAPTSMN1; SMN2POLB
SCHEMBL9710092 0.77 HTT (0.32)
SCHEMBL17629524 0.76 CHRNB2 (0.33) ALDH1A1SMN1; SMN2
SCHEMBL2788345 0.76 CHRNB2 (0.33) ALDH1A1SMN1; SMN2
SCHEMBL8589177 0.73
SCHEMBL7291405 0.72 HPGD (0.34) ALDH1A1SMN1; SMN2
SCHEMBL2550000 0.72 HSD11B1 (0.31) ALDH1A1HSD11B1
SCHEMBL4016775 0.71 SMN1; SMN2 (0.32) SMN1; SMN2

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
WO-2004000806-A1 AMIDES OF CYCLIC AMINO ACIDS USED AS PDE 4 INHIBITORS ELBION AG (DE) 2003-12-31 WO claimed
WO-2004000806-A1 AMIDES OF CYCLIC AMINO ACIDS USED AS PDE 4 INHIBITORS ELBION AG (DE) 2003-12-31 WO disclosed