Fluoride Ion

Fluoride Ion

SCHEMBL9004749

Fc1cccc(C(F)(F)F)c1[Ti+](C1=CC=CC1)C1=CC=CC1.[F-]

nearest known ligand 0.31

Full drug profile on Sugi Atlas →

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
HSD11B1 P28845 1/20 0.31

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
Hydrochloric Acid SCHEMBL10384331 0.74 KDM4E (0.30) ALDH1A1
Thiocyanic Acid SCHEMBL9004773 0.69
Trifluoroacetic Acid SCHEMBL7937712 0.67 ALDH1A1 (0.32) ALDH1A1
Fluoride SCHEMBL9004753 0.66 HSD11B1 (0.31) HSD11B1
Hydrochloric Acid SCHEMBL9004729 0.65 CES2 (0.35) ALDH1A1
SCHEMBL7602903 0.61 HSD11B1 (0.41) ALDH1A1HSD11B1
SCHEMBL972079 0.60 ALDH1A1 (0.41) ALDH1A1
SCHEMBL173020 0.60 HSD11B1 (0.45) ALDH1A1HSD11B1
SCHEMBL8717849 0.59
Hydrochloric Acid SCHEMBL2399293 0.59

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
US-5510539-A LIQUID KETALS; LONG DARK STORAGE STABILITY CIBA-GEIGY CORPORATION (US) 1996-04-23 US disclosed
US-5288917-A Benzil ketals; end-capped polyoxyyethylene glycol; mixed with titanocene-type initiators CIBA-GEIGY CORPORATION (US) 1994-02-22 US disclosed
US-4963470-A PHOTOINITIATORS CIBA-GEIGY CORPORATION (US) 1990-10-16 US disclosed
US-4960746-A A-HYDROXY-OR A-AMINO-ACETOPHENONES AND A TITANOCENE COMPOUND SUBSTITUTED BY FLUORINE CIBA-GEIGY CORPORATION (US) 1990-10-02 US disclosed