SCHEMBL30887233

SCHEMBL30887233

C=CC(=O)OCCc1ccc(Nc2ccc(Nc3ccc(CCOC(=O)C=C)cc3)c3c2C(=O)c2ccccc2C3=O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.56
▸ RAB9A P51151 2/20 0.56
▸ LMNA P02545 2/20 0.56
▸ MAPK1 P28482 2/20 0.56
▸ MEN1 O00255 2/20 0.56
▸ KMT2A Q03164 2/20 0.56
▸ MAPT P10636 2/20 0.56
▸ NPSR1 Q6W5P4 1/20 0.56
▸ TDP1 Q9NUW8 1/20 0.56
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ SIRT2 Q8IXJ6 2/20 0.43
▸ MTOR P42345 1/20 0.43
▸ THRB P10828 1/20 0.42
▸ CYP1A2 P05177 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ PRKCA P17252 1/20 0.40
▸ HCAR2 Q8TDS4 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39

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
SCHEMBL9915558 0.92 NPC1 (0.48) NPC1RAB9ALMNAMAPK1MEN1
SCHEMBL8343624 0.87 THRB (0.56) NPC1RAB9ALMNAMAPK1MEN1
SCHEMBL30887190 0.86 MAPK1 (0.53) NPC1RAB9ALMNAMAPK1MEN1
SCHEMBL18368207 0.83 MAPT (0.47) NPC1RAB9ALMNAMAPK1MEN1
SCHEMBL29462117 0.83 MAPT (0.55) NPC1RAB9ALMNAMAPK1MEN1
SCHEMBL261845 0.83 MAPT (0.55) NPC1RAB9ALMNAMAPK1MEN1
SCHEMBL1802604 0.81 NPC1 (0.55) NPC1RAB9ALMNAMAPK1MEN1
SCHEMBL13884741 0.81 MAPT (0.71) NPC1RAB9ALMNAMAPK1MEN1
SCHEMBL30749688 0.80 MAPT (0.61) NPC1RAB9ALMNAMAPK1MEN1
SCHEMBL13295527 0.80 MAPT (0.69) NPC1RAB9ALMNAMAPK1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024074814-A9 COMPOSITION COMPRISING A FUNCTIONALISED DYE AND A DIALLYLAMINE COMONOMER AND USE THEREOF SUBLINO LIMITED (GB) 2025-05-22 — — WO disclosed
WO-2024074814-A1 COMPOSITION COMPRISING A FUNCTIONALISED DYE AND A DIALLYLAMINE COMONOMER AND USE SUBLINO LIMITED (GB) 2024-04-11 — — WO disclosed
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