SCHEMBL11445554

SCHEMBL11445554

Cc1ccc(COP(O)O)cc1.[Zn]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AGXT P21549 2/20 0.50
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
MAPK1 P28482 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
GAA P10253 1/20 0.41
THRB P10828 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
CASP1 P29466 1/20 0.41
BLM P54132 1/20 0.41

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
SCHEMBL3104659 0.84 AGXT (0.52) AGXTCA1CA2CA9NPC1
Tromethamine SCHEMBL11412653 0.84 AGXT (0.44) AGXTCA1CA2CA9NPC1
SCHEMBL4965791 0.79 AGXT (0.56) AGXTCA1CA2CA9NPC1
SCHEMBL8389173 0.79 IDO1 (0.52) CA1CA2CA9NPC1RAB9A
SCHEMBL11444701 0.77 TSHR (0.50) AGXTCA1CA2CA9NPC1
SCHEMBL8389197 0.77 IDO1 (0.55) AGXTCA1CA2CA9NPC1
SCHEMBL9715924 0.76 IDO1 (0.52) AGXTCA1CA2CA9RAB9A
SCHEMBL28066876 0.76 IDO1 (0.52) ALDH1A1MAPTKDM4EMEN1HPGD
SCHEMBL2128784 0.75 TSHR (0.52) AGXTCA1CA2CA9NPC1
Zinc Ion SCHEMBL11445553 0.74 AGXT (0.50) AGXTCA1CA2CA9NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4224218-A Stabilized vinyl chloride polymer comprising a metal mono-organic phosphite ARGUS CHEMICAL CORPORATION (US) 1980-09-23 US disclosed