SCHEMBL11079372

SCHEMBL11079372

CCCCCCOCCCCCCCCCCCSCCCO

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
THRB P10828 2/20 0.61
MAPT P10636 2/20 0.61
HTT P42858 1/20 0.61
TSHR P16473 2/20 0.50
LMNA P02545 2/20 0.46
HSD17B10 Q99714 2/20 0.46
ALDH1A1 P00352 1/20 0.46
USP2 O75604 1/20 0.44
CES2 O00748 4/20 0.42
GMNN O75496 1/20 0.42
TP53 P04637 1/20 0.42
POLB P06746 1/20 0.42
CYP2C9 P11712 1/20 0.42
BLM P54132 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
FAAH O00519 4/20 0.42
CES1 P23141 4/20 0.42
PLA2G6 O60733 1/20 0.42

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
SCHEMBL11080723 1.00 MEN1 (0.61) MEN1KMT2ATHRBMAPTHTT
SCHEMBL11081399 1.00 MEN1 (0.61) MEN1KMT2ATHRBMAPTHTT
SCHEMBL11077154 1.00 MEN1 (0.61) MEN1KMT2ATHRBMAPTHTT
SCHEMBL11086153 0.96 MEN1 (0.61) MEN1KMT2ATHRBMAPTHTT
SCHEMBL11081916 0.94 MEN1 (0.59) MEN1KMT2ATHRBMAPTHTT
Phosphoric Acid SCHEMBL11080585 0.91 THRB (0.52) MEN1KMT2ATHRBMAPTHTT
Phosphoric Acid SCHEMBL11089176 0.91 THRB (0.52) MEN1KMT2ATHRBMAPTHTT
Phosphoric Acid SCHEMBL11080135 0.91 THRB (0.52) MEN1KMT2ATHRBMAPTHTT
SCHEMBL10931986 0.90 MEN1 (0.53) MEN1KMT2ATHRBMAPTHTT
SCHEMBL11086847 0.90 TSHR (0.54) MEN1KMT2ATHRBMAPTHTT

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
EP-0050327-B1 PHOSPHOLIPIDS THAT CONTAIN SULPHUR, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THESE COMPOUNDS Roche Diagnostics GmbH (DE) 1984-06-20 EP disclosed
US-4444766-A ANTITUMOR BOEHRINGER MANNHEIM GMBH (DE) 1984-04-24 US disclosed
EP-0050327-A1 Phospholipids that contain sulphur, process for their preparation and medicines containing these compounds Roche Diagnostics GmbH (DE) 1982-04-28 EP disclosed