SCHEMBL15545751

SCHEMBL15545751

CC(C)COP(=O)(O)S.[NaH]

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.35
GAA P10253 1/20 0.35
ANPEP P15144 3/20 0.33
LAP3 P28838 3/20 0.33
ERAP1 Q9NZ08 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TSHR P16473 2/20 0.31
PGK1 P00558 1/20 0.31
PGK2 P07205 1/20 0.31
MMP1 P03956 1/20 0.31
MMP8 P22894 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
SCHEMBL24909871 0.83 PGK1 (0.32) ANPEPLAP3ERAP1PGK1PGK2
SCHEMBL10580539 0.80 GAA (0.37) CYP3A4GAAMEN1KMT2AALDH1A1
SCHEMBL269622 0.77 CYP3A4 (0.38) CYP3A4GAAANPEPLAP3ERAP1
SCHEMBL759100 0.77
SCHEMBL5337067 0.77 ALDH1A1 (0.36) CYP3A4GAAMEN1KMT2AALDH1A1
SCHEMBL9257926 0.75
SCHEMBL11756337 0.75 PGK1 (0.48) PGK1PGK2
Ammonia Solution, Strong SCHEMBL23014452 0.75 GAA (0.37) CYP3A4GAAMEN1KMT2AALDH1A1
SCHEMBL1635172 0.75 PGK1 (0.48) PGK1PGK2
SCHEMBL23014392 0.75 GAA (0.37) CYP3A4GAAMEN1KMT2AALDH1A1

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-20150209801-A1 MONOTHIOPHOSPHATE CONTAINING COLLECTORS AND METHODS TEEBEE HOLDINGS PTY LTD (AU) 2015-07-30 US disclosed
WO-2014012139-A1 MONOTHIOPHOSPHATE CONTAINING COLLECTORS AND METHODS TEEBEE HOLDINGS PTY LTD (AU) 2014-01-23 WO disclosed