SCHEMBL6380949

SCHEMBL6380949

C=CCO[PH](C)=O.C[PH](=O)O

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
KMT2A Q03164 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA7 P43166 1/20 0.30

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
SCHEMBL10511144 0.93
SCHEMBL30887 0.77
Propene SCHEMBL28207333 0.76 TSHR (0.31) TSHR
Ammonia Solution, Strong SCHEMBL2540911 0.75
SCHEMBL2546207 0.75
SCHEMBL2542185 0.75
SCHEMBL2540639 0.75
SCHEMBL11147148 0.75
SCHEMBL2538053 0.75
Butane SCHEMBL2150699 0.74 TSHR (0.37) TSHR

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-6838277-B1 Furthering the enzymatic destruction of nerve agents THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 2005-01-04 US disclosed