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SCHEMBL10899802

SCHEMBL10899802

CC1(C)CC(C(CC(=O)O)(C(=O)O)C(C(=O)O)(C2CC(C)(C)N(C(=O)Oc3ccccc3)C(C)(C)C2)C(C(=O)O)(C2CC(C)(C)N(C(=O)Oc3ccccc3)C(C)(C)C2)C2CC(C)(C)N(C(=O)Oc3ccccc3)C(C)(C)C2)CC(C)(C)N1C(=O)Oc1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ RORC P51449 1/20 0.32
▸ NPY2R P49146 4/20 0.31
▸ CYP2D6 P10635 2/20 0.31
▸ TSHR P16473 1/20 0.31
▸ CHRNA7 P36544 1/20 0.31
▸ HTR3A P46098 1/20 0.31
▸ ABCB1 P08183 1/20 0.30
▸ USP2 O75604 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ RAB9A P51151 1/20 0.30

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
SCHEMBL10410061 0.80 — —
SCHEMBL10904677 0.80 GAA (0.34) GAAALDH1A1SMN1; SMN2NPY2RCYP2D6
SCHEMBL7509065 0.78 — —
SCHEMBL9589839 0.77 — —
SCHEMBL6725394 0.73 — —
SCHEMBL10904204 0.73 GAA (0.39) GAAALDH1A1SMN1; SMN2RORCNPY2R
SCHEMBL10904674 0.72 GAA (0.34) GAAALDH1A1SMN1; SMN2RORCNPY2R
SCHEMBL9590254 0.72 — —
SCHEMBL76202 0.71 GAA (0.30) GAA
SCHEMBL6064905 0.71 GAA (0.38) GAAMAPK1

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
US-4623685-A 1-PHENOXYCARBONYL-2,2,6,6-TETRAMETHYLPIPERIDYL COMPOUND ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1986-11-18 — — US claimed
US-4623685-A 1-PHENOXYCARBONYL-2,2,6,6-TETRAMETHYLPIPERIDYL COMPOUND ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1986-11-18 — — US disclosed