SCHEMBL9779474

SCHEMBL9779474

CC(C)(C)OC(=O)CNc1cccs1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 11/20 0.40
MEN1 O00255 9/20 0.40
KMT2A Q03164 9/20 0.40
HSD17B10 Q99714 9/20 0.40
PTPRC P08575 2/20 0.39
MAPT P10636 8/20 0.39
RAB9A P51151 5/20 0.39
NPC1 O15118 4/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
TSHR P16473 1/20 0.39
ALOX15 P16050 7/20 0.38
TP53 P04637 5/20 0.38
HTT P42858 3/20 0.38
USP2 O75604 2/20 0.38
POLB P06746 1/20 0.38
ALDH1A1 P00352 5/20 0.38
PKM P14618 2/20 0.38
HPGD P15428 2/20 0.38
KDM4E B2RXH2 2/20 0.38
GFER P55789 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
SCHEMBL1839853 0.83 GAA (0.44) GAAMEN1KMT2AHSD17B10MAPT
Hydrochloric Acid SCHEMBL2746299 0.82 GAA (0.43) GAAMEN1KMT2AHSD17B10MAPT
SCHEMBL9779443 0.81 GAA (0.41) GAAMEN1KMT2AHSD17B10MAPT
SCHEMBL13436803 0.79 MEN1 (0.50) GAAMEN1KMT2AHSD17B10MAPT
SCHEMBL8076055 0.79 GAA (0.41) GAAMEN1KMT2AHSD17B10MAPT
SCHEMBL25003323 0.78 MALT1 (0.51) GAAMEN1KMT2AHSD17B10MAPT
SCHEMBL3451518 0.76 KMT2A (0.48) GAAMEN1KMT2ANPC1USP2
SCHEMBL399012 0.76 GAA (0.50) GAAMEN1KMT2AHSD17B10MAPT
SCHEMBL16096864 0.75 CTSK (0.46) GAAMEN1KMT2AHSD17B10RAB9A
SCHEMBL29126042 0.75 CTSK (0.41) GAAMEN1KMT2AHSD17B10MAPT

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-5015659-A Cognition activators to slow aging of the brain CASSELLA AKTIENGESELLSCHAFT (DE) 1991-05-14 US disclosed