Fluoride

Fluoride

SCHEMBL1254178

C=CC(=O)OCC(O)CN(CC)CC.F

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.50
HPGD P15428 1/20 0.44
LMNA P02545 2/20 0.42
ABCB1 P08183 4/20 0.41
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 4/20 0.36
TP53 P04637 3/20 0.36
HIF1A Q16665 3/20 0.36
CYP3A4 P08684 2/20 0.36
HSD17B10 Q99714 1/20 0.36
THRB P10828 1/20 0.35
ACHE P22303 1/20 0.34
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL1254957 0.98 TSHR (0.52) TSHRHPGDLMNAABCB1L3MBTL1
Hydrochloric Acid SCHEMBL1254946 0.97 TSHR (0.50) TSHRHPGDLMNAABCB1L3MBTL1
Bromide SCHEMBL1254987 0.97 TSHR (0.50) TSHRHPGDLMNAABCB1L3MBTL1
Iodide SCHEMBL1254370 0.97 TSHR (0.50) TSHRHPGDLMNAABCB1L3MBTL1
Acrylic Acid Methyl Ester SCHEMBL27684592 0.92 TSHR (0.46) TSHRHPGDLMNAABCB1L3MBTL1
SCHEMBL16407301 0.90 TSHR (0.47) TSHRHPGDLMNAABCB1L3MBTL1
Methacrylic Acid SCHEMBL27716379 0.90 TSHR (0.44) TSHRHPGDLMNAABCB1L3MBTL1
SCHEMBL1302161 0.83 TSHR (0.50) TSHRHPGDLMNAABCB1ALDH1A1
Fluoride SCHEMBL1254145 0.83 TSHR (0.53) TSHRHPGDLMNAABCB1ALDH1A1
SCHEMBL1302837 0.82 TSHR (0.49) TSHRHPGDLMNAALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8461237-B2 Gel composition, method of preparing the same, and impact resistant absorbing material using the same 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-06-11 US disclosed
EP-2387866-A1 ELECTROMAGNETIC WAVE SHIELDING GEL-LIKE COMPOSITION 3M Innovative Properties Company (US) 2011-11-23 EP disclosed
US-20110268950-A1 Electromagnetic Wave Shielding Gel-Like Composition 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-11-03 US disclosed
US-8038066-B2 Laser scanner with deformable lens HAND HELD PRODUCTS, INC. (US) 2011-10-18 US disclosed
US-20110097585-A1 GEL COMPOSITION, METHOD OF PREPARING THE SAME, AND IMPACT RESISTANT ABSORBING MATERIAL USING THE SAME 3M INNOVATIVE PROPERTIES COMPANY 2011-04-28 US disclosed
EP-2285900-A2 GEL COMPOSITION, METHOD FOR PREPARING THE SAME, AND IMPACT RESISTANT ABSORBING MATERIAL USING THE SAME 3M Innovative Properties Company (US) 2011-02-23 EP disclosed
WO-2010083075-A1 ELECTROMAGNETIC WAVE SHIELDING GEL-LIKE COMPOSITION 3M INNOVATIVE PROPERTIES COMPANY (US) 2010-07-22 WO disclosed
WO-2009134694-A2 GEL COMPOSITION, METHOD FOR PREPARING THE SAME, AND IMPACT RESISTANT ABSORBING MATERIAL USING THE SAME 3M INNOVATIVE PROPERTIES COMPANY (US) 2009-11-05 WO disclosed