SCHEMBL6282895

SCHEMBL6282895

NC(O)(CC1CCCCC1)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.53
GRM3 Q14832 1/20 0.53
CYP2D6 P10635 1/20 0.39
ALOX5 P09917 2/20 0.38
HPGD P15428 2/20 0.36
SLC1A3 P43003 2/20 0.36
SLC1A2 P43004 2/20 0.36
SLC1A1 P43005 2/20 0.36
LMNA P02545 1/20 0.35
METAP1 P53582 1/20 0.35
EPHX1 P07099 4/20 0.34
KMT2A Q03164 1/20 0.34
SIGMAR1 Q99720 1/20 0.33

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
SCHEMBL10701341 0.82 GRM2 (0.44) GRM2GRM3CYP2D6ALOX5HPGD
SCHEMBL8745906 0.82 GRM2 (0.44) GRM2GRM3CYP2D6ALOX5HPGD
Hydrochloric Acid SCHEMBL8745883 0.80 GRM2 (0.42) GRM2GRM3CYP2D6ALOX5HPGD
SCHEMBL3614328 0.78 GRM2 (0.51) GRM2GRM3CYP2D6ALOX5HPGD
SCHEMBL8957923 0.78 GRM2 (0.51) GRM2GRM3CYP2D6ALOX5HPGD
SCHEMBL3614325 0.78 GRM2 (0.51) GRM2GRM3CYP2D6ALOX5HPGD
SCHEMBL28752678 0.77 GRM2 (0.46) GRM2GRM3CYP2D6ALOX5HPGD
SCHEMBL3102113 0.76 GRM2 (0.50) GRM2GRM3CYP2D6ALOX5HPGD
SCHEMBL3102119 0.76 GRM2 (0.50) GRM2GRM3CYP2D6ALOX5HPGD
SCHEMBL28773150 0.75 GRM2 (0.49) GRM2GRM3CYP2D6ALOX5HPGD

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
JP-2005298337-A METHOD FOR PRODUCING β-HYDROXYAMINO ACID DERIVATIVE AND INTERMEDIATE OF THE SAME ONO PHARMACEUT CO LTD 2005-10-27 JP disclosed