SCHEMBL27719635

SCHEMBL27719635

FC(F)C(F)C1CNCCO1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 16/20 0.35
SLC6A4 P31645 16/20 0.35
SLC6A3 Q01959 12/20 0.35
HRH1 P35367 4/20 0.35
MLNR O43193 1/20 0.33
ADRB2 P07550 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
HTR2C P28335 1/20 0.33
OPRK1 P41145 1/20 0.33
KCNH2 Q12809 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 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
SCHEMBL22265191 0.88 SLC6A2 (0.34) SLC6A2SLC6A4SLC6A3HRH1MLNR
SCHEMBL16985411 0.82
SCHEMBL16985363 0.82
SCHEMBL3936878 0.82
Hydrochloric Acid SCHEMBL28104876 0.80 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3HRH1MLNR
Hydrochloric Acid SCHEMBL28105006 0.80 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3HRH1MLNR
Hydrochloric Acid SCHEMBL16975421 0.80 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3HRH1MLNR
SCHEMBL23929455 0.73
SCHEMBL516648 0.73
SCHEMBL12206943 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101784534-A Process for preparing oxazoline protected aminodiol compounds useful as intermediates of florfenicol SCHERING PLOUGH LTD 2010-07-21 CN claimed
CN-101300227-B Process for preparing ester oxazolidine compounds and their conversion to florfenicol SCHERING PLOUGH LTD 2013-07-03 CN disclosed
CN-102131772-A Process for the preparation of oxazoline-protected aminodiol compounds useful as intermediates for florfenicol INTERVET INT BV 2011-07-20 CN disclosed
CN-101796037-A Processes for preparing oxazolidine-and oxazolidinone-aminodiols and related intermediates INTERVET INTERMATONAL B V 2010-08-04 CN disclosed
CN-101300227-A Process for preparing ester * oxazolidine compound and its conversion to florfenicol SCHERING PLOUGH LTD (CH) 2008-11-05 CN disclosed
CN-101300237-A Process for preparing oxazolidine protected aminodiol compounds useful as intermediates to florfenicol SCHERING PLOUGH LTD (CH) 2008-11-05 CN disclosed
CN-101300238-A Improved process for the preparation of * oxazolidine protected aminodiol compounds useful as florfenicol intermediates SCHERING PLOUGH LTD (CH) 2008-11-05 CN disclosed