SCHEMBL5287811

SCHEMBL5287811

CCCCc1cc[n+](CC)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 2/20 0.45
▸ CA1 P00915 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.44
▸ HSD17B10 Q99714 2/20 0.44
▸ HPGD P15428 1/20 0.44
▸ TP53 P04637 2/20 0.43
▸ CYP2D6 P10635 2/20 0.43
▸ CYP2C9 P11712 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ GGPS1 O95749 1/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ LMNA P02545 2/20 0.42
▸ HTT P42858 2/20 0.42
▸ ESR1 P03372 2/20 0.42
▸ ADRA2A P08913 2/20 0.42

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 SCHEMBL29251947 0.98 CYP2D6 (0.44) CA2CA1ALDH1A1HSD17B10HPGD
Hydrochloric Acid SCHEMBL29252384 0.94 CA2 (0.41) CA2CA1ALDH1A1HSD17B10HPGD
SCHEMBL5301161 0.93 ESR1 (0.50) CA2ALDH1A1HSD17B10TP53CYP2D6
SCHEMBL5305135 0.91 ESR1 (0.53) ALDH1A1HSD17B10TP53CYP2D6CYP2C9
SCHEMBL5301499 0.91 ESR1 (0.53) ALDH1A1HSD17B10TP53CYP2D6CYP2C9
SCHEMBL5301887 0.91 ESR1 (0.53) ALDH1A1HSD17B10TP53CYP2D6CYP2C9
SCHEMBL5286019 0.91 ESR1 (0.53) ALDH1A1HSD17B10TP53CYP2D6CYP2C9
SCHEMBL5299547 0.91 ESR1 (0.53) ALDH1A1HSD17B10TP53CYP2D6CYP2C9
SCHEMBL5300770 0.91 ESR1 (0.53) ALDH1A1HSD17B10TP53CYP2D6CYP2C9
SCHEMBL5815750 0.91 ESR1 (0.53) ALDH1A1HSD17B10TP53CYP2D6CYP2C9

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-106661735-A Palladium plating solution and palladium coating obtained using same 日本高纯度化学株式会社 2017-05-10 — — CN claimed
WO-2024142789-A1 GOLD ELECTROPLATING SOLUTION AND METHOD FOR PRODUCING GOLD-ELECTROPLATED COATING 日本高純度化学株式会社 2024-07-04 — — WO disclosed
CN-106661735-B Palladium plating solution and palladium coating film obtained using the same 日本高纯度化学株式会社 2019-12-10 — — CN disclosed
CN-106661735-A Palladium plating solution and palladium coating obtained using same 日本高纯度化学株式会社 2017-05-10 — — CN disclosed
WO-2007006418-A1 IONIC-LIQUID-CONTAINING PRODUCTS FOR DYEING AND/OR BRIGHTENING KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-01-18 — — WO disclosed
WO-2006131234-A1 COSMETIC COMPOSITIONS COMPRISING IONIC LIQUIDS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-12-14 — — WO disclosed
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