SCHEMBL27134652

SCHEMBL27134652

CCCCOc1ccc(OC(=O)NCCC(=O)O)cc1

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 5/20 0.58
FAAH O00519 9/20 0.58
GAA P10253 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52

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
SCHEMBL3197299 0.82 NPC1 (0.69)
SCHEMBL11668425 0.81 MGLL (0.77) MGLL
SCHEMBL3949450 0.79 TAAR1 (0.54) FAAHGAA
SCHEMBL29089242 0.79 PLA2G4B (0.68) GAAL3MBTL1
SCHEMBL3188560 0.79 L3MBTL1 (0.62) FAAHGAAL3MBTL1
SCHEMBL13812883 0.78 MGLL (0.54) MGLLFAAH
SCHEMBL5219284 0.77 FAAH (0.78) FAAH
SCHEMBL6757097 0.77 FAAH (0.58) MGLLFAAH
SCHEMBL3209637 0.77 NPC1 (0.69) GAAL3MBTL1
SCHEMBL3205711 0.77 LTA4H (0.60) GAAL3MBTL1

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-2024043313-A1 REVERSIBLE THERMOCHROMIC COMPOSITION, MICROENCAPSULATED PIGMENT USING SAID REVERSIBLE THERMOCHROMIC COMPOSITION, WRITING TOOL, AND TOY 三菱ケミカル株式会社 2024-02-29 WO disclosed