SCHEMBL9807362

SCHEMBL9807362

CN(C)C(=S)N(C)C.CNC(=S)N(C)C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS2R38 P59533 1/20 0.59
LMNA P02545 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA9 Q16790 2/20 0.33
ALDH1A1 P00352 3/20 0.32
TP53 P04637 2/20 0.32
HPGD P15428 2/20 0.32
ALOX15 P16050 2/20 0.32
ALOX12 P18054 2/20 0.32
MAPK1 P28482 2/20 0.32
HSD17B10 Q99714 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
HIF1A Q16665 1/20 0.32
HTT P42858 2/20 0.30
MGLL Q99685 2/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30

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
SCHEMBL80483 0.91
SCHEMBL8943103 0.88
Hydrogen Sulfide SCHEMBL8943099 0.88
SCHEMBL11704750 0.81 TAS2R38 (0.38) TAS2R38LMNAL3MBTL1CA12CA1
Urea SCHEMBL23094030 0.78 LMNA (0.35) TAS2R38LMNAL3MBTL1CA12CA1
SCHEMBL15657 0.77
Hydrogen Sulfide SCHEMBL10361973 0.73
SCHEMBL31468923 0.73
Iodide SCHEMBL27689365 0.73
Thiosulfuric Acid SCHEMBL11480124 0.72 LMNA (0.32) LMNAL3MBTL1ALDH1A1

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-0424187-A1 Process for the preparation of pillared clays and the pillared clays obtained from the process RHONE-POULENC CHIMIE (FR) 1991-04-24 EP disclosed