SCHEMBL9777975

SCHEMBL9777975

C=CCO[Si](=O)OCCCCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.41
ALDH1A1 P00352 1/20 0.38
HCAR2 Q8TDS4 2/20 0.34
HPGD P15428 1/20 0.33
CA1 P00915 6/20 0.31
CA2 P00918 6/20 0.31
CA9 Q16790 6/20 0.31
PLA2G2C Q5R387 1/20 0.31
LPAR3 Q9UBY5 3/20 0.31
LPAR1 Q92633 2/20 0.31
LPAR2 Q9HBW0 2/20 0.31
NAAA Q02083 1/20 0.31
CA12 O43570 1/20 0.31
CA3 P07451 1/20 0.31
CA4 P22748 1/20 0.31
CA6 P23280 1/20 0.31
CA5A P35218 1/20 0.31
CA7 P43166 1/20 0.31
CA14 Q9ULX7 1/20 0.31
CA5B Q9Y2D0 1/20 0.31

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
SCHEMBL3097694 0.83 CA1 (0.41) TSHRHCAR2HPGDCA1CA2
SCHEMBL543795 0.81 CA1 (0.43) TSHRHCAR2HPGDCA1CA2
SCHEMBL76191 0.81 CA1 (0.43) TSHRHCAR2HPGDCA1CA2
SCHEMBL2781039 0.81 CA1 (0.43) TSHRHCAR2HPGDCA1CA2
SCHEMBL5144532 0.81 CA1 (0.43) TSHRHCAR2HPGDCA1CA2
SCHEMBL2537728 0.81 CA1 (0.43) TSHRHCAR2HPGDCA1CA2
SCHEMBL36807 0.78
SCHEMBL76345 0.76 CYP3A4 (0.42) TSHRALDH1A1HCAR2HPGDCA1
SCHEMBL8837209 0.75 CA1 (0.39) TSHRHCAR2HPGDCA1CA2
SCHEMBL16341193 0.72 CYP3A4 (0.39) TSHRALDH1A1HCAR2HPGDCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5000866-A Antifreeze compositions containing alkane tetracarboxylic acid for use with hard water FIRST BRANDS CORPORATION (US) 1991-03-19 US disclosed
EP-0217340-B1 CARBOXY-SUBSTITUTED ORGANOSILICON STABILIZERS FOR A SILICATE-CONTAINING ANTIFREEZE UNION CARBIDE CORPORATION (US) 1990-12-12 EP disclosed
US-4822901-A Carboxy-substituted organosilicon stabilizers for a silicate-containing antifreeze UNION CARBIDE CORPORATION (US) 1989-04-18 US disclosed
US-4772408-A CORROSION RESISTANCE, GELATION INHIBITION FIRST BRANDS CORPORATION (US) 1988-09-20 US disclosed
US-4767599-A Silicate-containing antifreeze with carboxy-substituted organosilicon stabilizer FIRST BRANDS CORPORATION (US) 1988-08-30 US disclosed
US-4725405-A Organosiloxane-silicate copolymer antifreeze composition with nitrate corrosion inhibitor FIRST BRANDS CORPORATION (US) 1988-02-16 US disclosed
US-4701277-A Silicate-containing antifreeze with carboxy-substituted organosilicon stabilizer FIRST BRANDS CORPORATION (US) 1987-10-20 US disclosed
US-4684475-A Organophosphate and silicate containing antifreeze FIRST BRANDS CORPORATION (US) 1987-08-04 US disclosed
US-4676919-A Low pH-buffered silicon/silicate antifreeze concentrates FIRST BRANDS CORPORATION (US) 1987-06-30 US disclosed
US-4664833-A AUTOMOBILE COOLANTS UNION CARBIDE CORPORATION (US) 1987-05-12 US disclosed
EP-0217340-A2 Carboxy-substituted organosilicon stabilizers for a silicate-containing antifreeze UNION CARBIDE CORPORATION (US) 1987-04-08 EP disclosed
EP-0105803-B1 ORTHOSILICATE ESTER CONTAINING HEAT TRANSFER FLUIDS UNION CARBIDE CORPORATION (US) 1986-06-18 EP disclosed
US-4460478-A GLYCOL, ORGANIC ORTHO-SILICATE, CORROSION RESISTANCE UNION CARBIDE CORPORATION (US) 1984-07-17 US disclosed
EP-0105803-A1 Orthosilicate ester containing heat transfer fluids UNION CARBIDE CORPORATION (US) 1984-04-18 EP disclosed
EP-0097583-A2 Aluminum corrosion inhibitor composition comprising a graft copolymer and a silicate UNION CARBIDE CORPORATION (US) 1984-01-04 EP disclosed
US-4404114-A AQUEOUS OR ALCOHOLIC SOLUTION OF AN UNSATURATED ACID-POLYETHER GRAFT POLYMER AND A SILICATE; SOLAR CELLS; INTERNAL COMBUSTION ENGINES UNION CARBIDE CORPORATION (US) 1983-09-13 US disclosed