SCHEMBL25285062

SCHEMBL25285062

CCCCC/C=C\C/C=C\CCCCCCCCOC(=O)c1cc(C(=O)OCCCCCCCC/C=C\C/C=C\CCCCC)cc(C(=O)OC(C)(C)C)c1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 7/20 0.52
▸ AKR1C4 P17516 1/20 0.52
▸ AKR1C3 P42330 1/20 0.52
▸ AKR1C2 P52895 1/20 0.52
▸ AKR1C1 Q04828 1/20 0.52
▸ MAPT P10636 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ MGLL Q99685 2/20 0.44
▸ FAAH O00519 1/20 0.44
▸ PLA2G4B P0C869 1/20 0.44
▸ PLA2G4A P47712 1/20 0.44
▸ BLM P54132 1/20 0.44
▸ PLA2G4C Q9UP65 1/20 0.44

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
SCHEMBL25708279 0.95 ESR1 (0.50) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL25285458 0.86 ESR1 (0.56) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL22503890 0.84 ESR1 (0.53) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL16013154 0.84 ESR1 (0.53) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL17685778 0.84 ESR1 (0.53) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL16154819 0.84 ESR1 (0.53) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL16013155 0.84 ESR1 (0.53) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL25283017 0.82 ESR1 (0.54) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL25278732 0.82 ESR1 (0.52) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL25231397 0.82 ESR1 (0.52) ESR1AKR1C4AKR1C3AKR1C2AKR1C1

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
EP-4452930-A1 IONIZABLE AMINE AND ESTER LIPIDS AND LIPID NANOPARTICLES Beam Therapeutics Inc. (US) 2024-10-30 — — EP disclosed
WO-2023121970-A1 IONIZABLE AMINE AND ESTER LIPIDS AND LIPID NANOPARTICLES BEAM THERAPEUTICS INC. (US) 2023-06-29 — — WO disclosed
WO-2023121970-A1 IONIZABLE AMINE AND ESTER LIPIDS AND LIPID NANOPARTICLES BEAM THERAPEUTICS INC. (US) 2023-06-29 — — WO disclosed
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