Fluoride

Fluoride

SCHEMBL28444337

CCC[n+]1ccn(C)c1.F

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
HSP90AA1 P07900 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL293655 1.00
SCHEMBL15720671 1.00 MEN1 (0.32) MEN1HSP90AA1KMT2ASMN1; SMN2
Iodide SCHEMBL3774569 0.98 MEN1 (0.31) MEN1HSP90AA1KMT2ASMN1; SMN2
Fluoride Ion SCHEMBL1898576 0.98 MEN1 (0.31) MEN1HSP90AA1KMT2ASMN1; SMN2
Water SCHEMBL28929077 0.98 MEN1 (0.31) MEN1HSP90AA1KMT2ASMN1; SMN2
Bromide SCHEMBL557294 0.98 MEN1 (0.34) MEN1HSP90AA1KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL556930 0.98 MEN1 (0.31) MEN1HSP90AA1KMT2ASMN1; SMN2
Iodide SCHEMBL180141 0.98 MAOA (0.32) MEN1HSP90AA1KMT2ASMN1; SMN2
SCHEMBL25362450 0.92
SCHEMBL15732334 0.92

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111511871-A Enhanced ice melting composition saturation and methods of use 巴斯夫欧洲公司 2020-08-07 CN claimed
CN-111511871-A Enhanced ice melting composition saturation and methods of use 巴斯夫欧洲公司 2020-08-07 CN disclosed