Fluorosalan

Fluorosalan

SCHEMBL8668901

O=C(Nc1ccc(C(F)(F)F)cc1)c1cc(Br)cc(Br)c1O.O=C(Nc1cccc(C(F)(F)F)c1)c1cc(Br)cc(Br)c1O

nearest known ligand 0.91

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.91
HTT P42858 3/20 0.91
KMT2A Q03164 3/20 0.91
OPRK1 P41145 1/20 0.91
HSPD1 P10809 2/20 0.64
HSPE1 P61604 2/20 0.64
MAPT P10636 4/20 0.62
PTGS1 P23219 2/20 0.62
ALDH1A1 P00352 1/20 0.62
EGFR P00533 1/20 0.62
LMNA P02545 1/20 0.62
ERBB2 P04626 1/20 0.62
CYP1A2 P05177 1/20 0.62
LCK P06239 1/20 0.62
CYP2C9 P11712 1/20 0.62
MAPK1 P28482 1/20 0.62
MAPK14 Q16539 1/20 0.62
MAOB P27338 1/20 0.59
P2RX1 P51575 2/20 0.57
RXFP1 Q9HBX9 9/20 0.57

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
Fluorosalan SCHEMBL29484458 0.95 MEN1 (1.00) MEN1HTTKMT2AOPRK1HSPD1
Fluorosalan SCHEMBL30318966 0.95 MEN1 (1.00) MEN1HTTKMT2AOPRK1HSPD1
Fluorosalan SCHEMBL374268 0.95 MEN1 (1.00) MEN1HTTKMT2AOPRK1HSPD1
Fluorosalan SCHEMBL30288529 0.95 MEN1 (1.00) MEN1HTTKMT2AOPRK1HSPD1
SCHEMBL574776 0.92 MEN1 (0.74) MEN1HTTKMT2AOPRK1HSPD1
SCHEMBL4922276 0.82 MEN1 (0.76) MEN1HTTKMT2AOPRK1HSPD1
SCHEMBL331050 0.81 MEN1 (0.74) MEN1HTTKMT2AOPRK1HSPD1
Metabromsalan SCHEMBL29350968 0.79 HSPD1 (1.00) MEN1HTTKMT2AOPRK1HSPD1
Metabromsalan SCHEMBL1162534 0.79 HSPD1 (1.00) MEN1HTTKMT2AOPRK1HSPD1
SCHEMBL330388 0.79 TMPRSS4 (0.78) MEN1HTTKMT2AOPRK1MAPT

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-0693919-B1 ORAL COMPOSITIONS FOR TREATING PLAQUE AND GINGIVITIS CONTAINING A NONCATIONIC ANTIBACTERIAL AGENT AND A BICARBONATE SALT PROCTER & GAMBLE (US) 1998-12-23 EP disclosed