SCHEMBL10693136

SCHEMBL10693136

CCCCCCCCCCOCCCS(=O)(=O)CCCOCCCCCCCCCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.50
THRB P10828 1/20 0.50
HTT P42858 1/20 0.50
KMT2A Q03164 1/20 0.50
MAPT P10636 1/20 0.50
CA2 P00918 10/20 0.48
CA1 P00915 9/20 0.48
CA9 Q16790 8/20 0.48
CA12 O43570 3/20 0.48
CA7 P43166 3/20 0.48
CA14 Q9ULX7 3/20 0.48
CA3 P07451 2/20 0.48
CA4 P22748 2/20 0.48
CA6 P23280 2/20 0.48
CA5A P35218 2/20 0.48
CA5B Q9Y2D0 2/20 0.48
CES2 O00748 3/20 0.47
RECQL P46063 2/20 0.47
GLA P06280 1/20 0.47
HPGD P15428 1/20 0.47

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
SCHEMBL5442905 1.00 MEN1 (0.50) MEN1THRBHTTKMT2AMAPT
SCHEMBL10695392 0.95 CA2 (0.54) MEN1THRBHTTKMT2AMAPT
SCHEMBL7846189 0.95 CA2 (0.54) MEN1THRBHTTKMT2AMAPT
SCHEMBL20145783 0.84 PLA2G2C (0.50) MEN1THRBHTTKMT2AMAPT
SCHEMBL838281 0.83 MEN1 (0.52) MEN1THRBHTTKMT2AMAPT
SCHEMBL20145776 0.83 MEN1 (0.52) MEN1THRBHTTKMT2AMAPT
SCHEMBL21167216 0.83 MEN1 (0.52) MEN1THRBHTTKMT2AMAPT
SCHEMBL10549046 0.83 MEN1 (0.52) MEN1THRBHTTKMT2AMAPT
Sulfuric Acid SCHEMBL343673 0.81 MEN1 (0.60) MEN1THRBHTTKMT2AMAPT
Sulfuric Acid SCHEMBL2148238 0.81 MEN1 (0.60) MEN1THRBHTTKMT2AMAPT

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
EP-0255366-A2 Nitrogen- and sulfur-containing lipid compound, their production and use Takeda Chemical Industries, Ltd. (JP) 1988-02-03 EP disclosed