SCHEMBL31024516

SCHEMBL31024516

CCCCCC=CCC=CCCCCCCCCC(CCCCCCBr)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.54
▸ PPARG P37231 5/20 0.54
▸ F7 P08709 4/20 0.54
▸ F3 P13726 4/20 0.54
▸ PPARD Q03181 4/20 0.54
▸ PPARA Q07869 4/20 0.54
▸ KDM4E B2RXH2 4/20 0.54
▸ FFAR1 O14842 3/20 0.54
▸ LMNA P02545 2/20 0.54
▸ CYP3A4 P08684 2/20 0.54
▸ CYP19A1 P11511 2/20 0.54
▸ FABP4 P15090 2/20 0.54
▸ HPGD P15428 2/20 0.54
▸ ALOX15 P16050 2/20 0.54
▸ PTGS1 P23219 2/20 0.54
▸ AKR1C3 P42330 2/20 0.54
▸ NR4A2 P43354 2/20 0.54
▸ HSD17B10 Q99714 2/20 0.54
▸ TDP1 Q9NUW8 2/20 0.54
▸ FABP3 P05413 2/20 0.54

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
SCHEMBL32660081 1.00 ALDH1A1 (0.54) ALDH1A1PPARGF7F3PPARD
SCHEMBL31252253 1.00 ALDH1A1 (0.54) ALDH1A1PPARGF7F3PPARD
SCHEMBL31024519 1.00 ALDH1A1 (0.54) ALDH1A1PPARGF7F3PPARD
SCHEMBL18350212 0.92 ALDH1A1 (0.62) ALDH1A1PPARGF7F3PPARD
SCHEMBL17967764 0.92 ALDH1A1 (0.62) ALDH1A1PPARGF7F3PPARD
SCHEMBL27628050 0.92 ALDH1A1 (0.62) ALDH1A1PPARGF7F3PPARD
SCHEMBL7031627 0.92 ALDH1A1 (0.62) ALDH1A1PPARGF7F3PPARD
SCHEMBL14931806 0.92 ALDH1A1 (0.62) ALDH1A1PPARGF7F3PPARD
SCHEMBL17967767 0.92 ALDH1A1 (0.62) ALDH1A1PPARGF7F3PPARD
SCHEMBL27608914 0.92 ALDH1A1 (0.62) ALDH1A1PPARGF7F3PPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024183821-A1 IONIZABLE LIPID MOLECULE, PREPARATION METHOD THEREFOR AND USE THEREOF 上海吉量医药工程有限公司 2024-09-12 — — WO disclosed
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