SCHEMBL28425877

SCHEMBL28425877

NC[C@H]1CN(c2ccc(N3CCN(c4ccccc4)CC3)c(F)c2)C(=O)O1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 13/20 0.56
MAOA P21397 5/20 0.56
LMNA P02545 2/20 0.56
PTGS1 P23219 1/20 0.56
CALML3 P27482 1/20 0.56
SDHA P31040 1/20 0.56
ALDH1A1 P00352 1/20 0.53
MAPT P10636 1/20 0.53
MAPK1 P28482 1/20 0.53
GFER P55789 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
F10 P00742 6/20 0.50

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
SCHEMBL28425878 1.00 MAOB (0.56) MAOBMAOALMNAPTGS1CALML3
Hydrochloric Acid SCHEMBL28428124 0.99 MAOB (0.55) MAOBMAOALMNAPTGS1CALML3
Hydrochloric Acid SCHEMBL28428123 0.99 MAOB (0.55) MAOBMAOALMNAPTGS1CALML3
SCHEMBL78384 0.89 MAOB (0.57) MAOBMAOALMNAPTGS1CALML3
SCHEMBL28428084 0.89 MAOB (0.58) MAOBMAOALMNAPTGS1CALML3
SCHEMBL28110345 0.89 MAOB (0.58) MAOBMAOALMNAPTGS1CALML3
SCHEMBL1336215 0.89 MAOB (0.69) MAOBMAOALMNAPTGS1CALML3
SCHEMBL76846 0.89 MAOB (0.69) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5513933 0.89 MAOB (0.69) MAOBMAOALMNAPTGS1CALML3
SCHEMBL29439547 0.89 MAOB (0.69) MAOBMAOALMNAPTGS1CALML3

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
CN-107286111-B Preparation method of oxazolidinone compound 广东赛法洛药业有限公司 2020-06-19 CN claimed
CN-107286111-B Preparation method of oxazolidinone compound 广东赛法洛药业有限公司 2020-06-19 CN disclosed