Diethyl Pyrocarbonate

Diethyl Pyrocarbonate

SCHEMBL27970760

C1CCOC1.CCOC(=O)OC(=O)OCC

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SOAT1 P35610 1/20 0.65
▸ ALDH1A1 P00352 6/20 0.50
▸ TSHR P16473 2/20 0.47
▸ LMNA P02545 3/20 0.44
▸ POLB P06746 1/20 0.44
▸ RECQL P46063 1/20 0.43
▸ RAB9A P51151 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ MAPT P10636 2/20 0.41
▸ HPGD P15428 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.37
▸ GAA P10253 2/20 0.37
▸ ALOX15 P16050 1/20 0.36
▸ MGAM O43451 1/20 0.36
▸ SI P14410 1/20 0.36
▸ MGAM2 Q2M2H8 1/20 0.36

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
Tetrahydrofuran SCHEMBL27801282 0.91 ALDH1A1 (0.62) SOAT1ALDH1A1TSHRLMNAPOLB
Ethyl Propionate SCHEMBL28137333 0.83 LMNA (0.53) SOAT1ALDH1A1TSHRLMNAPOLB
Tetrahydrofuran SCHEMBL26646373 0.82 TSHR (0.50) SOAT1ALDH1A1TSHRLMNAPOLB
Diethyl Pyrocarbonate SCHEMBL15582 0.81 SOAT1 (1.00) SOAT1ALDH1A1TSHRLMNAMAPT
Diethyl Pyrocarbonate SCHEMBL30366210 0.81 SOAT1 (1.00) SOAT1ALDH1A1TSHRLMNAMAPT
Ethyl Acetate SCHEMBL3776197 0.80 ALDH1A1 (0.64) ALDH1A1TSHRLMNAPOLBRECQL
Ethyl Acetate SCHEMBL6544884 0.80 ALDH1A1 (0.64) ALDH1A1TSHRLMNAPOLBRECQL
Ethyl Acetate SCHEMBL130336 0.80 ALDH1A1 (0.64) ALDH1A1TSHRLMNAPOLBRECQL
Ethyl Acetate SCHEMBL16332300 0.80 ALDH1A1 (0.64) ALDH1A1TSHRLMNAPOLBRECQL
Ethyl Acetate SCHEMBL15194119 0.80 ALDH1A1 (0.64) ALDH1A1TSHRLMNAPOLBRECQL

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
CN-104276946-A Preparation method of juvenile hormone analogue SYNERGETICA CHANGZHOU CHEMICAL CO LTD 2015-01-14 — — CN disclosed
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