Fluoride

Fluoride

SCHEMBL17359722

CCCCCCCCNCCN(CC)CC.F

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.56
ALDH1A1 P00352 1/20 0.56
PAOX Q6QHF9 1/20 0.50
S1PR2 O95136 5/20 0.42
S1PR4 O95977 5/20 0.42
S1PR1 P21453 5/20 0.42
S1PR3 Q99500 5/20 0.42
S1PR5 Q9H228 1/20 0.42
EPHX1 P07099 4/20 0.41
ADH1B P00325 1/20 0.41
ADH1C P00326 1/20 0.41
ADH1A P07327 1/20 0.41
ADH4 P08319 1/20 0.41
ADH7 P40394 1/20 0.41
PLA2G1B P04054 1/20 0.39
PLA2G2A P14555 1/20 0.39
CHRM2 P08172 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL25634930 0.98 TSHR (0.59) TSHRALDH1A1PAOXS1PR2S1PR4
SCHEMBL27414590 0.98 TSHR (0.59) TSHRALDH1A1PAOXS1PR2S1PR4
SCHEMBL8473674 0.98 TSHR (0.59) TSHRALDH1A1PAOXS1PR2S1PR4
SCHEMBL9244555 0.98 TSHR (0.59) TSHRALDH1A1PAOXS1PR2S1PR4
SCHEMBL29090473 0.98 TSHR (0.59) TSHRALDH1A1PAOXS1PR2S1PR4
SCHEMBL10964171 0.98 TSHR (0.59) TSHRALDH1A1PAOXS1PR2S1PR4
SCHEMBL8470770 0.98 TSHR (0.59) TSHRALDH1A1PAOXS1PR2S1PR4
SCHEMBL8470713 0.98 TSHR (0.59) TSHRALDH1A1PAOXS1PR2S1PR4
SCHEMBL3784120 0.96 TSHR (0.62) TSHRALDH1A1PAOXS1PR2S1PR4
SCHEMBL28426636 0.89 ALDH1A1 (0.54) TSHRALDH1A1PAOXS1PR2S1PR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117425464-A Oral care compositions 高露洁-棕榄公司 2024-01-19 CN claimed
CN-117320683-A Oral care compositions 高露洁-棕榄公司 2023-12-29 CN claimed
CN-120204052-B Composition for biomimetic remineralization of dentin and application thereof 江苏省人民医院(南京医科大学第一附属医院) 2026-02-27 CN disclosed
CN-118319786-A Oral care compositions and methods 高露洁-棕榄公司 2024-07-12 CN disclosed
CN-118234476-A Oral care compositions comprising glycolipids and mild surfactants 巴斯夫欧洲公司 2024-06-21 CN disclosed
CN-118215460-A Oral care compositions 高露洁-棕榄公司 2024-06-18 CN disclosed
CN-117425464-A Oral care compositions 高露洁-棕榄公司 2024-01-19 CN disclosed
CN-117320683-A Oral care compositions 高露洁-棕榄公司 2023-12-29 CN disclosed
CN-116761585-A Oral care compositions with natural sweetener systems 高露洁-棕榄公司 2023-09-15 CN disclosed
CN-116685303-A Oral care compositions comprising ascorbic acid derivatives 高露洁-棕榄公司 2023-09-01 CN disclosed
CN-115475108-A Composition for tooth protection paint and preparation and use method thereof 高露洁-棕榄公司 2022-12-16 CN disclosed
CN-108472214-B Zinc alginate sodium structurant and preparation and use methods thereof 高露洁-棕榄公司 2022-01-04 CN disclosed
CN-113840635-A Oral compositions and methods of use 3M创新有限公司 2021-12-24 CN disclosed
CN-113811282-A Oral compositions and methods of use 3M创新有限公司 2021-12-17 CN disclosed
CN-109152936-B Therapeutic toothpaste and related methods and kits 3M创新有限公司 2021-08-27 CN disclosed
US-9220673-B2 Surface-treated calcium phosphate particles suitable for oral care and dental compositions 3M INNOVATIVE PROPERTIES COMPANY (US) 2015-12-29 US disclosed