SCHEMBL15219631

SCHEMBL15219631

NC[C@H]1CN(c2ccc(N3CCOCC3)c(F)c2)CC(=O)O1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOB P27338 11/20 0.51
MAOA P21397 4/20 0.51
LMNA P02545 1/20 0.51
PTGS1 P23219 1/20 0.51
CALML3 P27482 1/20 0.51
SDHA P31040 1/20 0.51
F10 P00742 2/20 0.47
NPC1 O15118 2/20 0.41
PDE3B Q13370 3/20 0.41
PDE3A Q14432 2/20 0.41
USP30 Q70CQ3 1/20 0.40
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL76846 0.84 MAOB (0.69) MAOBMAOALMNAPTGS1CALML3
SCHEMBL29439547 0.84 MAOB (0.69) MAOBMAOALMNAPTGS1CALML3
SCHEMBL1336215 0.84 MAOB (0.69) MAOBMAOALMNAPTGS1CALML3
SCHEMBL5513933 0.84 MAOB (0.69) MAOBMAOALMNAPTGS1CALML3
Acetic Acid SCHEMBL1338393 0.79 MAOB (0.74) MAOBMAOALMNAPTGS1CALML3
Acetic Acid SCHEMBL1338391 0.79 MAOB (0.74) MAOBMAOALMNAPTGS1CALML3
SCHEMBL27723554 0.76 MAOB (0.45) MAOBMAOALMNAPTGS1CALML3
SCHEMBL27861030 0.76 MAOB (0.45) MAOBMAOALMNAPTGS1CALML3
SCHEMBL27832281 0.76 MAOB (0.45) MAOBMAOALMNAPTGS1CALML3
SCHEMBL8240342 0.75 BPTF (0.67) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2388251-B1 METHOD FOR PREPARING LINEZOLID AND INTERMEDIATES THEREOF LIANHE CHEMICAL TECHNOLOGY CO LTD (CN) 2013-08-28 EP disclosed