Fluoride

Fluoride

SCHEMBL7182536

CCCCCCCCCCCCCCCCCC(C)(C)N.F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 4/20 0.47
FDPS P14324 2/20 0.46
TSHR P16473 2/20 0.44
THRB P10828 1/20 0.44
DNM1 Q05193 8/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 1/20 0.41
EPHX1 P07099 1/20 0.41
GGPS1 O95749 1/20 0.39

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
Fluoride SCHEMBL9443893 1.00 SMPD1 (0.47) SMPD1FDPSTSHRTHRBDNM1
Fluoride SCHEMBL27924658 1.00 SMPD1 (0.47) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL613861 0.97 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL123602 0.97 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL161035 0.97 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL160808 0.97 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL8981471 0.97 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL162599 0.97 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL615147 0.97 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1
SCHEMBL8383508 0.97 SMPD1 (0.48) SMPD1FDPSTSHRTHRBDNM1

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-0970033-B1 PROCESS FOR PREPARATION OF AROMATIC COMPOUNDS VICTREX MFG LTD (GB) 2003-05-28 EP disclosed
US-6274770-B1 PARTICULARLY, ALTHOUGH NOT EXCLUSIVELY, RELATES TO THE PREPARATION OF SUBSTITUTED BENZOPHENONE COMPOUNDS, FOR EXAMPLE, 4,4'-DIFLUOROBENZOPHENONE. VICTREX MANUFACTURING LIMITED (GB) 2001-08-14 US disclosed
EP-0970033-A1 PROCESS FOR PREPARATION OF AROMATIC COMPOUNDS VICTREX MANUFACTURING LIMITED (GB) 2000-01-12 EP disclosed
WO-1998040338-A1 PROCESS FOR PREPARATION OF AROMATIC COMPOUNDS VICTREX MANUFACTURING LIMITED (GB) 1998-09-17 WO disclosed