SCHEMBL10832365

SCHEMBL10832365

CC(C)C(=O)N[C@H]1[C@@H](OCc2ccccc2)O[C@@H]2COC(C)(C)O[C@H]2[C@@H]1O

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ MAG P20916 1/20 0.36
▸ HCRTR2 O43614 5/20 0.35
▸ HCRTR1 O43613 4/20 0.35
▸ TMEM97 Q5BJF2 2/20 0.34
▸ SIGMAR1 Q99720 2/20 0.34
▸ GSTP1 P09211 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ YWHAZ P63104 1/20 0.33
▸ BCHE P06276 1/20 0.33
▸ PKM P14618 1/20 0.33

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
SCHEMBL1836110 0.91 L3MBTL1 (0.54) L3MBTL1MAGTMEM97SIGMAR1ALDH1A1
SCHEMBL5308210 0.91 L3MBTL1 (0.54) L3MBTL1MAGTMEM97SIGMAR1ALDH1A1
SCHEMBL15012280 0.88 L3MBTL1 (0.46) L3MBTL1ALDH1A1
SCHEMBL10832088 0.88 L3MBTL1 (0.59) L3MBTL1MAGHCRTR2HCRTR1TMEM97
SCHEMBL16146024 0.86 L3MBTL1 (0.45) L3MBTL1MAGHCRTR2HCRTR1TMEM97
SCHEMBL10831723 0.86 L3MBTL1 (0.51) L3MBTL1MAGHCRTR2HCRTR1TMEM97
SCHEMBL10832391 0.86 L3MBTL1 (0.41) L3MBTL1MAGTMEM97SIGMAR1YWHAZ
SCHEMBL10417606 0.86 L3MBTL1 (0.41) L3MBTL1MAGALDH1A1BCHE
SCHEMBL11269209 0.85 L3MBTL1 (0.44) L3MBTL1MAG
SCHEMBL8431552 0.83 L3MBTL1 (0.42) L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4574058-A Antigen derivatives and processes for their preparation CIBA-GEIGY CORPORATION (US) 1986-03-04 — — US disclosed
US-4446128-A Antigen derivatives and processes for their preparation CIBA-GEIGY CORPORATION (US) 1984-05-01 — — US disclosed
US-4397844-A Antigen derivatives and processes for their preparation CIBA-GEIGY CORPORATION (US) 1983-08-09 — — US disclosed
EP-0003833-B1 ANTIGEN DERIVATIVES, PROCESS FOR THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CIBA-GEIGY AG (CH) 1983-07-20 — — EP disclosed
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