SCHEMBL28178050

SCHEMBL28178050

CCCCOC(=O)NCCCl

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 14/20 0.67
▸ FAAH O00519 1/20 0.50
▸ EPHX1 P07099 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.47

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
SCHEMBL29250462 0.93 ACHE (0.73) ACHEFAAHEPHX1
SCHEMBL29380101 0.88 ACHE (0.59) ACHEFAAHALDH1A1
SCHEMBL8381680 0.86 ACHE (0.74) ACHEEPHX1ALDH1A1
SCHEMBL3975468 0.86 ACHE (0.88) ACHEEPHX1
SCHEMBL7569673 0.86 ACHE (0.81) ACHEEPHX1
SCHEMBL10939707 0.86 ACHE (0.81) ACHEEPHX1
SCHEMBL10827960 0.85 ACHE (0.78) ACHEEPHX1
SCHEMBL2853012 0.84 ACHE (0.85) ACHEEPHX1
SCHEMBL7785857 0.84 ACHE (0.85) ACHEEPHX1
SCHEMBL13387437 0.84 ACHE (0.85) ACHEEPHX1

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
WO-2025090758-A1 AHR AGONISTS ELI LILLY AND COMPANY (US) 2025-05-01 — — WO disclosed
CN-107129497-B Sophoridine derivatives containing nitrogen mustard and preparation method and application thereof 天津市医药科学研究所 2021-03-09 — — CN disclosed
CN-107129497-A The Sophoridine analog derivative of one class containing mustargen and its production and use 天津市医药科学研究所 2017-09-05 — — CN disclosed
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