SCHEMBL8463134

SCHEMBL8463134

CCOP(=O)(OCC)OCC#CCOP(=O)(OCC)OCC

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.68
TP53 P04637 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CYP3A4 P08684 2/20 0.39
ACHE P22303 1/20 0.37
PPARD Q03181 2/20 0.36
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL8612818 0.88 TSHR (0.59) TSHRTP53TDP1CYP3A4ACHE
SCHEMBL17877993 0.84 TSHR (0.48) TSHRTP53TDP1
Triethyl Phosphate SCHEMBL28023664 0.83 TSHR (1.00) TSHRTP53TDP1CYP3A4ACHE
Triethyl Phosphate SCHEMBL27822049 0.83 TSHR (1.00) TSHRTP53TDP1CYP3A4ACHE
Triethyl Phosphate SCHEMBL1332591 0.83 TSHR (1.00) TSHRTP53TDP1CYP3A4ACHE
Triethyl Phosphate SCHEMBL21887 0.83 TSHR (1.00) TSHRTP53TDP1CYP3A4ACHE
SCHEMBL8842390 0.83 TSHR (0.52) TSHRTP53TDP1CYP3A4ACHE
SCHEMBL11245636 0.80 TSHR (0.62) TSHRTP53TDP1CYP3A4ACHE
SCHEMBL561742 0.80 TSHR (0.62) TSHRTP53TDP1CYP3A4ACHE
SCHEMBL11208814 0.80 TSHR (0.62) TSHRTP53TDP1CYP3A4ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160190644-A1 RECHARGEABLE LITHIUM BATTERY SAMSUNG SDI CO., LTD. (KR) 2016-06-30 US disclosed
US-20160190644-A1 RECHARGEABLE LITHIUM BATTERY SAMSUNG SDI CO., LTD. (KR) 2016-06-30 US disclosed
US-5964919-A STABILIZING THE ACTIVE ZINC BY SUSPENDING IN A CONTAINER WITH AN SOLVENT SELECT FROM ETHER, HYDROCARBON, AROMATIC HYDROCARABON OR APROTIC SOLVENT UNDER INERT GAS, SEALING THE CONTAINER BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 1999-10-12 US disclosed
US-5358546-A Reacting a zinc compound with a reducting agent BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 1994-10-25 US disclosed
WO-1993015086-A1 HIGHLY REACTIVE FORMS OF ZINC AND REAGENTS THEREOF BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 1993-08-05 WO disclosed