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SCHEMBL31325645

SCHEMBL31325645

CCCCCCCCCCCCOC(=O)CC(C(=O)OC1CC(C)(C)NC(C)(C)C1)C(CC(=O)OC1CC(C)(C)NC(C)(C)C1)C(=O)OC1CC(C)(C)NC(C)(C)C1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 5/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ EPHX2 P34913 3/20 0.36
▸ RAD52 P43351 1/20 0.36
▸ FAAH O00519 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ PRKCA P17252 1/20 0.35
▸ HTR2C P28335 1/20 0.35
▸ DGKA P23743 1/20 0.34

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
SCHEMBL10887812 1.00 NAAA (0.40) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL373253 1.00 NAAA (0.40) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL379379 0.98 NPSR1 (0.39) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL6056018 0.98 NAAA (0.42) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL3798617 0.95 NAAA (0.37) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL2953406 0.95 NAAA (0.40) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL3803017 0.93 NAAA (0.39) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL2725067 0.92 NAAA (0.39) NAAANPSR1MAPTMAPK1L3MBTL1
SCHEMBL9718928 0.88 GAA (0.34) GAA
SCHEMBL13601678 0.87 NPSR1 (0.38) NAAANPSR1MAPTMAPK1L3MBTL1

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
US-20240384024-A1 CONDUIT TUBE AND THERMOPLASTIC POLYESTER ELASTOMER RESIN COMPOSITION TOYOBO MC CORPORATION (JP) 2024-11-21 — — US disclosed