SCHEMBL8713187

SCHEMBL8713187

CCN(CC)c1cccc(NS(=O)(=O)CC)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 1/20 0.52
ALDH1A1 P00352 3/20 0.47
CYP3A4 P08684 1/20 0.47
BRD4 O60885 3/20 0.44
ADRA2A P08913 1/20 0.44
ADRA1A P35348 1/20 0.44
LMNA P02545 2/20 0.43
HTT P42858 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
HPGD P15428 1/20 0.43
MAPT P10636 2/20 0.43
BRDT Q58F21 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
NOX1 Q9Y5S8 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
AURKA O14965 1/20 0.41
KDR P35968 1/20 0.41
AURKB Q96GD4 1/20 0.41

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
SCHEMBL29407201 0.87 NR3C1 (0.68) NR3C1ALDH1A1CYP3A4LMNAHTT
SCHEMBL5945125 0.87 NR3C1 (0.68) NR3C1ALDH1A1CYP3A4LMNAHTT
SCHEMBL6666233 0.86 NR3C1 (0.47) NR3C1ALDH1A1CYP3A4LMNAHTT
SCHEMBL11516593 0.86 BRD4 (0.48) NR3C1ALDH1A1CYP3A4BRD4LMNA
Hydrochloric Acid SCHEMBL11059615 0.85 NR3C1 (0.67) NR3C1ALDH1A1CYP3A4LMNAHTT
SCHEMBL10294704 0.85 ALDH1A1 (0.44) NR3C1ALDH1A1BRD4ADRA2AADRA1A
SCHEMBL11409417 0.84 HTT (0.54) NR3C1ALDH1A1CYP3A4BRD4LMNA
SCHEMBL3507875 0.83 CA2 (0.54) NR3C1ALDH1A1CYP3A4LMNAHTT
SCHEMBL10892304 0.81 ALDH1A1 (0.66) NR3C1ALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL10294170 0.80 NR3C2 (0.44) NR3C1ALDH1A1BRD4ADRA2AADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5760196-A PRINTING AND DYEING HYDROPHOBIC FIBERS OF POLYESTERS FOR COLORFASTNESS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-06-02 US disclosed
EP-0727464-A2 Monoazo compounds and methods for dyeing or printing hydrophobic fiber materials using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-08-21 EP disclosed