Fluoride Ion

Fluoride Ion

SCHEMBL64933

C[N+](C)(C)Cc1ccccc1.[F-].[F-].[F-].[H+].[H+]

nearest known ligand 0.85

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.85
KDM4E B2RXH2 1/20 0.85
TDP1 Q9NUW8 1/20 0.85
CHRNB2 P17787 2/20 0.50
CHRNA4 P43681 2/20 0.50
DNM1 Q05193 2/20 0.45
TP53 P04637 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPK1 P28482 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HTT P42858 2/20 0.42
CALM1 P0DP23 1/20 0.41
CHRNA7 P36544 1/20 0.41
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39
TSHR P16473 1/20 0.39
IDO1 P14902 1/20 0.38
LOXL2 Q9Y4K0 1/20 0.38

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 Ion SCHEMBL3902670 1.00 ALDH1A1 (0.85) ALDH1A1KDM4ETDP1CHRNB2CHRNA4
Fluoride Ion SCHEMBL238440 0.97 ALDH1A1 (0.90) ALDH1A1KDM4ETDP1CHRNB2CHRNA4
Fluoride Ion SCHEMBL28463996 0.97 ALDH1A1 (0.90) ALDH1A1KDM4ETDP1CHRNB2CHRNA4
SCHEMBL6651128 0.97 ALDH1A1 (0.90) ALDH1A1KDM4ETDP1CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL28763353 0.95 KDM4E (0.85) ALDH1A1KDM4ETDP1CHRNB2CHRNA4
Fluoride SCHEMBL9509379 0.95 ALDH1A1 (0.85) ALDH1A1KDM4ETDP1CHRNB2CHRNA4
Fluoride SCHEMBL2113507 0.95 ALDH1A1 (0.85) ALDH1A1KDM4ETDP1CHRNB2CHRNA4
Fluoride SCHEMBL9154164 0.95 ALDH1A1 (0.85) ALDH1A1KDM4ETDP1CHRNB2CHRNA4
Water SCHEMBL1724291 0.95 KDM4E (0.85) ALDH1A1KDM4ETDP1CHRNB2CHRNA4
Hydrogen Sulfide SCHEMBL5998720 0.95 ALDH1A1 (0.94) ALDH1A1KDM4ETDP1CHRNB2CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8207184-B2 Condensation compound between fluorinated cyclopentane ring and aromatic ring, and process for producing the same SUMITOMO CHEMICAL CO., LTD. (JP) 2012-06-26 US disclosed
US-8158275-B2 Fluorine-containing compound and method for producing same, fluorine-containing polymer, organic thin film, and organic thin film device OSAKA UNIVERSITY (JP) 2012-04-17 US disclosed
US-8129400-B2 Condensation compound between fluorinated cyclopentane ring and aromatic ring, and process for producing the same SUMITOMO CHEMICAL CO., LTD. (JP) 2012-03-06 US disclosed
US-20110282073-A1 CONDENSATION COMPOUND BETWEEN FLUORINATED CYCLOPENTANE RING AND AROMATIC RING, AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL CO., LTD. (JP) 2011-11-17 US disclosed
US-20110213162-A1 CONDENSATION COMPOUND BETWEEN FLUORINATED CYCLOPENTANE RING AND AROMATIC RING, AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL CO., LTD. (JP) 2011-09-01 US disclosed
US-8008336-B2 Forming electronic material, semiconductors SUMITOMO CHEMICAL CO., LTD. (JP) 2011-08-30 US disclosed
US-20100171102-A1 FLUORINE-CONTAINING POLYCYCLIC AROMATIC COMPOUND, FLUORINE-CONTAINING POLYMER, ORGANIC THIN FILM AND ORGANIC THIN FILM DEVICE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-07-08 US disclosed
EP-2133321-A1 FLUORINE-CONTAINING POLYCYCLIC AROMATIC COMPOUND, FLUORINE-CONTAINING POLYMER, ORGANIC THIN FILM AND ORGANIC THIN FILM DEVICE Sumitomo Chemical Company, Limited (JP) 2009-12-16 EP disclosed
US-20090240014-A1 FLUORINE-CONTAINING COMPOUND AND METHOD FOR PRODUCING SAME, FLUORINE-CONTAINING POLYMER, ORGANIC THIN FILM, AND ORGANIC THIN FILM DEVICE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-09-24 US disclosed
EP-1997821-A1 FLUORINE-CONTAINING COMPOUND AND METHOD FOR PRODUCING SAME, FLUORINE-CONTAINING POLYMER, ORGANIC THIN FILM, AND ORGANIC THIN FILM DEVICE Osaka University (JP) 2008-12-03 EP disclosed
US-20080207922-A1 Condensation Compound Between Fluorinated Cyclopentane Ring and Aromatic Ring, and Process for Producing the Same SUMITOMO CHEMICAL CO., LTD (JP) 2008-08-28 US disclosed
EP-1857452-A1 CONDENSATION COMPOUND BETWEEN FLUORINATED CYCLOPENTANE RING AND AROMATIC RING, AND PROCESS FOR PRODUCING THE SAME OSAKA UNIVERSITY (JP) 2007-11-21 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080207922-A1 Condensation Compound Between Fluorinated Cyclopentane Ring and Aromatic Ring, and Process for Producing the Same RCC1, AFF4, TPR ALDH1A1 3317/4885KDM4E 1633/4885TDP1 2969/4885
US-20100171102-A1 FLUORINE-CONTAINING POLYCYCLIC AROMATIC COMPOUND, FLUORINE-CONTAINING POLYMER, ORGANIC THIN FILM AND ORGANIC THIN FILM DEVICE AFF1, RFT1, AFF2 ALDH1A1 2144/4885KDM4E 3194/4885TDP1 1490/4885
US-20110213162-A1 CONDENSATION COMPOUND BETWEEN FLUORINATED CYCLOPENTANE RING AND AROMATIC RING, AND PROCESS FOR PRODUCING THE SAME RCC1, AFF4, TPR ALDH1A1 3317/4885KDM4E 1633/4885TDP1 2969/4885
US-20110282073-A1 CONDENSATION COMPOUND BETWEEN FLUORINATED CYCLOPENTANE RING AND AROMATIC RING, AND PROCESS FOR PRODUCING THE SAME RCC1, AFF4, TPR ALDH1A1 3317/4885KDM4E 1633/4885TDP1 2969/4885
US-20090240014-A1 FLUORINE-CONTAINING COMPOUND AND METHOD FOR PRODUCING SAME, FLUORINE-CONTAINING POLYMER, ORGANIC THIN FILM, AND ORGANIC THIN FILM DEVICE AFF1, AFF2, RFT1 ALDH1A1 849/4885KDM4E 2089/4885TDP1 2748/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.