SCHEMBL877255

SCHEMBL877255

CC(C)(C)NS(=O)(=O)c1nc2ccccc2s1.CC(C)CC(C)Nc1ccc(Nc2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.52
ALOX15 P16050 3/20 0.52
TSHR P16473 3/20 0.52
MAPK1 P28482 2/20 0.52
CYP3A4 P08684 2/20 0.52
ALOX12 P18054 2/20 0.52
HSD17B10 Q99714 2/20 0.52
HIF1A Q16665 1/20 0.52
PSMB8 P28062 1/20 0.39
PSMB5 P28074 1/20 0.39
KMT2A Q03164 7/20 0.38
MAPT P10636 6/20 0.38
MEN1 O00255 6/20 0.38
SMN1; SMN2 Q16637 6/20 0.38
NPC1 O15118 5/20 0.38
RAB9A P51151 5/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38

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
SCHEMBL29392184 0.79 PSMB8 (0.60) ALDH1A1ALOX15TSHRMAPK1PSMB8
SCHEMBL721698 0.79 PSMB8 (0.60) ALDH1A1ALOX15TSHRMAPK1PSMB8
SCHEMBL30903434 0.78 PSMB8 (0.58) ALDH1A1ALOX15TSHRMAPK1PSMB8
SCHEMBL31215174 0.72 ALDH1A1 (1.00) ALDH1A1ALOX15TSHRMAPK1CYP3A4
SCHEMBL39447 0.72 ALDH1A1 (1.00) ALDH1A1ALOX15TSHRMAPK1CYP3A4
SCHEMBL15476044 0.72 ALDH1A1 (1.00) ALDH1A1ALOX15TSHRMAPK1CYP3A4
SCHEMBL29251251 0.71 ALDH1A1 (0.90) ALDH1A1ALOX15TSHRMAPK1CYP3A4
SCHEMBL6328763 0.68 ALDH1A1 (0.90) ALDH1A1ALOX15TSHRMAPK1CYP3A4
SCHEMBL20996740 0.67 ALDH1A1 (0.87) ALDH1A1ALOX15TSHRMAPK1CYP3A4
SCHEMBL28522170 0.67 MAOB (0.49) ALDH1A1TSHRPSMB8PSMB5KMT2A

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
US-20120073724-A1 Tire with Improved Beads SOCIETE DE TECHNOLOGIE MICHELIN (FR) 2012-03-29 US disclosed