SCHEMBL5288762

SCHEMBL5288762

CCCCc1cc[n+](CCC)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 2/20 0.48
▸ CYP2D6 P10635 2/20 0.48
▸ CYP2C9 P11712 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ HTT P42858 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ LMNA P02545 2/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ 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
▸ CHRNA7 P36544 2/20 0.43

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 SCHEMBL30212669 0.98 CYP2D6 (0.47) TP53CYP2D6CYP2C9MEN1CYP1A2
Hydrochloric Acid SCHEMBL29251566 0.94 MAPT (0.44) TP53CYP2D6CYP2C9MEN1CYP1A2
SCHEMBL5309308 0.93 TP53 (0.52) TP53CYP2D6CYP2C9MEN1CYP1A2
SCHEMBL5296534 0.91 TP53 (0.55) TP53CYP2D6CYP2C9MEN1CYP1A2
SCHEMBL5296656 0.91 TP53 (0.55) TP53CYP2D6CYP2C9MEN1CYP1A2
SCHEMBL5301137 0.91 TP53 (0.55) TP53CYP2D6CYP2C9MEN1CYP1A2
SCHEMBL5286951 0.91 TP53 (0.55) TP53CYP2D6CYP2C9MEN1CYP1A2
SCHEMBL5294907 0.91 TP53 (0.55) TP53CYP2D6CYP2C9MEN1CYP1A2
SCHEMBL5817662 0.91 TP53 (0.55) TP53CYP2D6CYP2C9MEN1CYP1A2
SCHEMBL5290239 0.91 TP53 (0.55) TP53CYP2D6CYP2C9MEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
WO-2023046704-A1 ELECTROCHEMICAL GAS SENSOR AND ELECTROLYTE FOR AN ELECTROCHEMICAL GAS SENSOR Dräger Safety AG & Co. KGaA (DE) 2023-03-30 — — 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
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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