SCHEMBL10832391

SCHEMBL10832391

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

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ YWHAZ P63104 3/20 0.34
▸ CCKBR P32239 1/20 0.34
▸ SSTR5 P35346 1/20 0.34
▸ IDO1 P14902 1/20 0.33
▸ MAG P20916 1/20 0.33
▸ TACR1 P25103 1/20 0.32
▸ BCHE P06276 3/20 0.32
▸ SLC6A2 P23975 1/20 0.32
▸ TMEM97 Q5BJF2 1/20 0.31
▸ SIGMAR1 Q99720 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ HRAS P01112 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
SCHEMBL10832365 0.86 L3MBTL1 (0.45) L3MBTL1YWHAZMAGBCHETMEM97
SCHEMBL1836110 0.85 L3MBTL1 (0.54) L3MBTL1MAGTMEM97SIGMAR1KMT2A
SCHEMBL5308210 0.85 L3MBTL1 (0.54) L3MBTL1MAGTMEM97SIGMAR1KMT2A
SCHEMBL7154934 0.84 MEN1 (0.41) L3MBTL1YWHAZIDO1SLC6A2TMEM97
SCHEMBL10382694 0.84 L3MBTL1 (0.48) L3MBTL1CCKBRSSTR5MAGBCHE
SCHEMBL15012280 0.83 L3MBTL1 (0.46) L3MBTL1
SCHEMBL6567769 0.81 L3MBTL1 (0.39) L3MBTL1YWHAZSSTR5IDO1TACR1
SCHEMBL10831460 0.81 L3MBTL1 (0.39) L3MBTL1YWHAZSSTR5IDO1TACR1
SCHEMBL16146024 0.81 L3MBTL1 (0.45) L3MBTL1MAGBCHETMEM97SIGMAR1
SCHEMBL11269209 0.81 L3MBTL1 (0.44) L3MBTL1MAGMEN1KMT2A

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
Send feedback