SCHEMBL6902457

SCHEMBL6902457

CCCCCCCCCCC(C)N.CCOS(=O)(=O)O

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.72
OPRM1 P35372 1/20 0.57
SPHK1 Q9NYA1 1/20 0.44
LAP3 P28838 2/20 0.42
CA1 P00915 8/20 0.40
CA2 P00918 8/20 0.40
CA9 Q16790 7/20 0.40
CA12 O43570 3/20 0.40
CA7 P43166 3/20 0.40
CA14 Q9ULX7 3/20 0.40
CA3 P07451 2/20 0.40
CA4 P22748 2/20 0.40
CA6 P23280 2/20 0.40
CA5A P35218 2/20 0.40
CA5B Q9Y2D0 2/20 0.40
S1PR2 O95136 5/20 0.39
S1PR1 P21453 5/20 0.39
S1PR3 Q99500 5/20 0.39
S1PR4 O95977 4/20 0.39

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
SCHEMBL6900925 1.00 TP53 (0.72) TP53OPRM1SPHK1LAP3CA1
SCHEMBL6901755 1.00 TP53 (0.72) TP53OPRM1SPHK1LAP3CA1
SCHEMBL6900895 1.00 TP53 (0.72) TP53OPRM1SPHK1LAP3CA1
SCHEMBL6901086 1.00 TP53 (0.72) TP53OPRM1SPHK1LAP3CA1
SCHEMBL28339011 0.88 TP53 (0.56) TP53OPRM1SPHK1LAP3CA1
SCHEMBL6902067 0.87 TP53 (0.75) TP53OPRM1SPHK1LAP3S1PR2
SCHEMBL14816224 0.86 TP53 (0.53) TP53OPRM1SPHK1LAP3CA1
Tuaminoheptane SCHEMBL23928820 0.85 TP53 (1.00) TP53OPRM1SPHK1LAP3CA1
Tuaminoheptane SCHEMBL15475282 0.85 TP53 (1.00) TP53OPRM1SPHK1LAP3CA1
Dodecane SCHEMBL28621410 0.84 CA1 (0.46) TP53CA1CA2CA9CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0953605-B1 Flow improved polycarbonate composition TEIJIN LTD (JP) 2004-09-15 EP disclosed
EP-0640646-B1 Process for production of stabilized polycarnonate TEIJIN LTD (JP) 2002-11-06 EP disclosed
EP-1221459-A1 A stabilized polycarbonate TEIJIN LIMITED (JP) 2002-07-10 EP disclosed
US-6103856-A LINEAR AROMATIC POLYCARBONATE WHICH HAS BEEN PREPARED BY REACTING AN AROMATIC DIHYDROXY COMPOUND WITH A CARBONATE PRECURSOR THROUGH SOLUTION OR MELT POLYCONDENSATION AND CYCLIC AROMATIC CARBONATE TEIJIN LIMITED (JP) 2000-08-15 US disclosed
EP-0953605-A2 Flow improved polycarbonate composition TEIJIN LIMITED (JP) 1999-11-03 EP disclosed
US-5668202-A ADDING ORGANOSULFONATE OR SULFATE STABILIZER AFTER MELT POLYCONDENSATION TEIJIN LIMITED (JP) 1997-09-16 US disclosed
US-5494952-A CATALYTIC MELT CONDENSATION OF AROMATIC DIHYDROXY COMPOUND AND A CARBONIC ACID DIESTER UNTIL DESIRED VISCOSITY IS REACHED, THEN MIXING WITH STABILIZER CONTAINING QUATERNARY AMMONIUM OR PHOSPHONIUM SALTS OF ORGANIC SULFONIC ACIDS TEIJIN LIMITED (JP) 1996-02-27 US disclosed
US-5486555-A Process for production of stabilized polycarbonate TEIJIN LIMITED (JP) 1996-01-23 US disclosed
EP-0640646-A1 Process for production of stabilized polycarnonate TEIJIN LIMITED (JP) 1995-03-01 EP disclosed