SCHEMBL28665176

SCHEMBL28665176

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

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.34
▸ APAF1 O14727 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ PLA2G1B P04054 1/20 0.34
▸ HSP90AA1 P07900 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ ATG4B Q9Y4P1 1/20 0.34
▸ FDPS P14324 2/20 0.33

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
SCHEMBL18155009 0.93 MEN1 (0.38) MEN1APAF1NPC1PLA2G1BHSP90AA1
Bromide SCHEMBL28399586 0.91 MEN1 (0.41) MEN1APAF1NPC1PLA2G1BHSP90AA1
SCHEMBL28873569 0.90 MEN1 (0.42) MEN1APAF1NPC1PLA2G1BHSP90AA1
SCHEMBL28494741 0.87 MEN1 (0.51) MEN1APAF1NPC1PLA2G1BHSP90AA1
SCHEMBL28041597 0.87 MEN1 (0.51) MEN1APAF1NPC1PLA2G1BHSP90AA1
SCHEMBL28087214 0.87 MEN1 (0.51) MEN1APAF1NPC1PLA2G1BHSP90AA1
SCHEMBL28025389 0.86 — —
SCHEMBL29389 0.82 MEN1 (0.47) MEN1APAF1NPC1PLA2G1BHSP90AA1
SCHEMBL28241090 0.82 — —
SCHEMBL22313650 0.81 MEN1 (0.31) MEN1APAF1NPC1PLA2G1BHSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114437288-B Filtrate reducer for drilling fluid and preparation method and application thereof 中国石油化工股份有限公司 2023-04-11 — — CN disclosed
CN-114437288-A Filtrate reducer for drilling fluid and preparation method and application thereof 中国石油化工股份有限公司 2022-05-06 — — CN disclosed
CN-109648095-B Antimony nanosheet and stripping method thereof, and flexible photodetector and preparation method thereof 兰州大学 2021-12-14 — — CN disclosed
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