SCHEMBL6729295

SCHEMBL6729295

CC(C)OC(=O)OC(C)C.[MgH2]

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.56
HCAR2 Q8TDS4 1/20 0.42
CA12 O43570 8/20 0.38
CA1 P00915 8/20 0.38
CA2 P00918 8/20 0.38
CA9 Q16790 8/20 0.38
CA7 P43166 6/20 0.37
CA14 Q9ULX7 6/20 0.37
LMNA P02545 3/20 0.37
ADRA1A P35348 1/20 0.36
PDE4D Q08499 1/20 0.36
KDM4E B2RXH2 1/20 0.34
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PDCD1 Q15116 1/20 0.33
CD274 Q9NZQ7 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
SCHEMBL36670 0.96 TSHR (0.59) TSHRHCAR2CA12CA1CA2
Ammonia Solution, Strong SCHEMBL16191762 0.93 TSHR (0.56) TSHRHCAR2CA12CA1CA2
Water SCHEMBL27755453 0.93 TSHR (0.56) TSHRHCAR2CA12CA1CA2
Hydrogen Peroxide SCHEMBL28342534 0.93 TSHR (0.56) TSHRHCAR2CA12CA1CA2
SCHEMBL6726188 0.93 TSHR (0.56) TSHRHCAR2CA12CA1CA2
Hydrochloric Acid SCHEMBL15092480 0.93 TSHR (0.56) TSHRHCAR2CA12CA1CA2
Ethylene SCHEMBL10595082 0.90 TSHR (0.53) TSHRHCAR2CA12CA1CA2
Bicarbonate SCHEMBL6046311 0.90 TSHR (0.53) TSHRHCAR2CA12CA1CA2
SCHEMBL7282869 0.84 TSHR (0.48) TSHRHCAR2CA12CA1CA2
Ethylene Glycol SCHEMBL9471445 0.84 TSHR (0.48) TSHRHCAR2CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9464383-B2 Deacidification treatment of printed cellulosic materials SMITH RICHARD DANIEL (US) 2016-10-11 US disclosed
US-20130302524-A1 Deacidification Treatment Of Printed Cellulosic Materials SMITH RICHARD DANIEL (US) 2013-11-14 US disclosed
US-6676856-B1 PRESERVATION OF PAPER DOCUMENTS; ORGANIC MAGNESIUM, ALUMINUM OR ZINC CARBONATE, MOISTURE FREE LOWER ALCOHOL AND HYDROCARBON OR HYDROFLUOROCARBON SOLVENT SMITH RICHARD DANIEL (US) 2004-01-13 US disclosed
EP-1060220-B1 DEACIDIFICATION TREATMENT OF PRINTED CELLULOSIC MATERIALS SMITH RICHARD DANIEL (US) 2003-07-23 EP disclosed
EP-1060220-A4 DEACIDIFICATION TREATMENT OF PRINTED CELLULOSIC MATERIALS SMITH RICHARD DANIEL (US) 2001-08-01 EP disclosed
EP-1060220-A1 DEACIDIFICATION TREATMENT OF PRINTED CELLULOSIC MATERIALS SMITH, Richard Daniel (US) 2000-12-20 EP disclosed
WO-1999035207-A1 DEACIDIFICATION TREATMENT OF PRINTED CELLULOSIC MATERIALS SMITH RICHARD DANIEL (US) 1999-07-15 WO disclosed
US-4860685-A Treatment of cellulosic materials SMITH RICHARD D (US) 1989-08-29 US disclosed
EP-0230455-A4 TREATMENT OF CELLULOSIC MATERIALS. SMITH RICHARD DANIEL 1987-11-12 EP disclosed
EP-0230455-A1 TREATMENT OF CELLULOSIC MATERIALS SMITH, Richard Daniel (US) 1987-08-05 EP disclosed
WO-1987000217-A1 TREATMENT OF CELLULOSIC MATERIALS SMITH RICHARD DANIEL 1987-01-15 WO disclosed