SCHEMBL10832088

SCHEMBL10832088

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

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.59
▸ MAG P20916 1/20 0.34
▸ HCRTR2 O43614 5/20 0.33
▸ HCRTR1 O43613 4/20 0.33
▸ TMEM97 Q5BJF2 2/20 0.33
▸ SIGMAR1 Q99720 2/20 0.33
▸ GSTP1 P09211 2/20 0.32
▸ POLB P06746 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ BCHE P06276 1/20 0.31
▸ EPHX2 P34913 1/20 0.31

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
SCHEMBL10831723 0.93 L3MBTL1 (0.51) L3MBTL1MAGHCRTR2HCRTR1TMEM97
SCHEMBL10832365 0.88 L3MBTL1 (0.45) L3MBTL1MAGHCRTR2HCRTR1TMEM97
SCHEMBL10832730 0.84 L3MBTL1 (0.61) L3MBTL1MAGHCRTR2HCRTR1TMEM97
SCHEMBL10382694 0.82 L3MBTL1 (0.48) L3MBTL1MAGTMEM97SIGMAR1GSTP1
SCHEMBL9473154 0.82 L3MBTL1 (0.53) L3MBTL1MAGHCRTR2TMEM97SIGMAR1
SCHEMBL10947656 0.80 L3MBTL1 (0.52) L3MBTL1MAGHCRTR2GSTP1POLB
SCHEMBL10831595 0.80 L3MBTL1 (0.40) L3MBTL1
SCHEMBL10832230 0.80 L3MBTL1 (0.49) L3MBTL1TMEM97SIGMAR1GSTP1BCHE
SCHEMBL5308210 0.78 L3MBTL1 (0.54) L3MBTL1MAGTMEM97SIGMAR1POLB
SCHEMBL1836110 0.78 L3MBTL1 (0.54) L3MBTL1MAGTMEM97SIGMAR1POLB

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 3 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
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