SCHEMBL7628754

SCHEMBL7628754

CCOC(=O)C1CCN(c2ccc(N3CC(C(N)C(C)=O)OC3=O)cc2F)CC1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LGMN Q99538 2/20 0.51
MAOB P27338 7/20 0.49
MAOA P21397 4/20 0.49
LMNA P02545 1/20 0.48
PTGS1 P23219 1/20 0.48
CALML3 P27482 1/20 0.48
SDHA P31040 1/20 0.48
F10 P00742 7/20 0.46
ITGB3 P05106 6/20 0.46
PRSS1 P07477 6/20 0.46
PRSS2 P07478 6/20 0.46
ITGA2B P08514 6/20 0.46
PRSS3 P35030 6/20 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
SCHEMBL8143030 0.84 F10 (0.40) LGMNMAOBMAOAF10ITGB3
SCHEMBL6058747 0.83 MAOA (0.71) MAOBMAOALMNAPTGS1CALML3
SCHEMBL6058753 0.83 MAOA (0.71) MAOBMAOALMNAPTGS1CALML3
SCHEMBL6616153 0.81 MAOB (0.54) LGMNMAOBMAOALMNAPTGS1
SCHEMBL8143032 0.81 MAOB (0.54) LGMNMAOBMAOALMNAPTGS1
SCHEMBL8796264 0.81 MAOB (0.51) MAOBMAOALMNAPTGS1CALML3
SCHEMBL6764368 0.81 TOP2B (0.55) MAOBMAOALMNA
SCHEMBL6759903 0.80 TOP2B (0.67) MAOBLMNA
SCHEMBL2089026 0.78 MAOB (0.53) MAOBMAOALMNAPTGS1CALML3
SCHEMBL6988167 0.78 MAOB (0.48) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1212058-A1 TOPICAL TREATMENT FOR PREVENTION OF OCULAR INFECTIONS INSITE VISION INCORPORATED (US) 2002-06-12 EP disclosed
WO-2001019366-A1 TOPICAL TREATMENT FOR PREVENTION OF OCULAR INFECTIONS INSITE VISION INCORPORATED (US) 2001-03-22 WO disclosed
EP-1019385-A1 AMINOARYL OXAZOLIDINONE N-OXIDES PHARMACIA & UPJOHN COMPANY (US) 2000-07-19 EP disclosed
WO-1997010223-A1 AMINOARYL OXAZOLIDINONE N-OXIDES PHARMACIA & UPJOHN COMPANY (US) 1997-03-20 WO disclosed
EP-0750618-A1 OXAZOLIDINONE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM PHARMACIA & UPJOHN COMPANY (US) 1997-01-02 EP disclosed
WO-1995025106-A1 OXAZOLIDINONE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM PHARMACIA & UPJOHN COMPANY (US) 1995-09-21 WO disclosed