SCHEMBL28873569

SCHEMBL28873569

C=C[n+]1ccn(CCCC)c1.F[P-](F)(F)(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.42
▸ HSP90AA1 P07900 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ APAF1 O14727 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ PLA2G1B P04054 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ ATG4B Q9Y4P1 1/20 0.42
▸ FDPS P14324 16/20 0.35
▸ PON1 P27169 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
SCHEMBL28494741 0.94 MEN1 (0.51) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL28087214 0.94 MEN1 (0.51) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL28041597 0.94 MEN1 (0.51) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL29389 0.93 MEN1 (0.47) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
Water SCHEMBL28864305 0.92 MEN1 (0.46) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
Iodide SCHEMBL29164379 0.92 MEN1 (0.46) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
Bromide SCHEMBL30788 0.92 MEN1 (0.50) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
Hydrochloric Acid SCHEMBL3692896 0.92 MEN1 (0.46) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL3795277 0.90 MEN1 (0.42) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL28665176 0.90 MEN1 (0.34) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111621133-B High-dielectric low-loss polycarbonate composition and preparation method and application thereof 万华化学集团股份有限公司 2022-11-08 — — CN claimed
WO-2024005716-A1 COMPOSITE MATERIALS NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2024-01-04 — — WO disclosed
CN-111435705-B Repairing agent and repairing method thereof and method for preparing photoelectric film 杭州纤纳光电科技有限公司 2023-04-07 — — CN disclosed
CN-113429504-B Preparation method of semi-solid polyion liquid electrolyte for lithium battery 浙大宁波理工学院 2022-08-02 — — CN disclosed
CN-113429504-A Preparation method of semi-solid polyion liquid electrolyte for lithium battery 浙大宁波理工学院 2021-09-24 — — CN disclosed
CN-109749730-A A kind of high-efficiency environment friendly slickwater fracturing fluid drag reducer and preparation method thereof 大庆玮德化工有限公司 2019-05-14 — — CN disclosed
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