SCHEMBL8303868

SCHEMBL8303868

CC(=O)NCC1CN(c2cc(F)c(N3CCN(C(=O)COCc4ccccc4)CC3)c(F)c2)C(=O)O1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOA P21397 6/20 0.51
MAOB P27338 3/20 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
GRM5 P41594 6/20 0.48
F10 P00742 1/20 0.46

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
SCHEMBL8303867 1.00 MAOA (0.51) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7707437 0.94 GRM5 (0.49) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7707434 0.94 GRM5 (0.49) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7709965 0.91 GRM5 (0.48) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7709962 0.91 GRM5 (0.48) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7707114 0.91 GRM5 (0.46) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7707118 0.91 GRM5 (0.46) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7710002 0.90 GRM5 (0.45) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7709998 0.90 GRM5 (0.45) MAOAMAOBLMNAPTGS1CALML3
SCHEMBL7710192 0.89 GRM5 (0.46) MAOAMAOBLMNAPTGS1CALML3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0730591-B1 ESTERS OF SUBSTITUTED-HYDROXYACETYL PIPERAZINE PHENYL OXAZOLIDINONES UPJOHN CO (US) 1999-07-14 EP disclosed
US-5652238-A WATER SOLUBILITY; ANTIMICROBIAL AGENTS EFFECTIVE AGAINST RESISTANT STAPHYLOCOCCI, ENTEROCOCCI, AND STREPTOCOCCI PHARMACIA & UPJOHN COMPANY (US) 1997-07-29 US disclosed
EP-0730591-A1 ESTERS OF SUBSTITUTED-HYDROXYACETYL PIPERAZINE PHENYL OXAZOLIDINONES PHARMACIA & UPJOHN COMPANY (US) 1996-09-11 EP disclosed
WO-1995014684-A1 ESTERS OF SUBSTITUTED-HYDROXYACETYL PIPERAZINE PHENYL OXAZOLIDINONES THE UPJOHN COMPANY (US) 1995-06-01 WO disclosed