SCHEMBL27617545

SCHEMBL27617545

CC(C)(C)OC(=O)c1cccc2c(=O)c3ccccc3sc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
MAPT P10636 4/20 0.44
HCRTR1 O43613 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
LMNA P02545 2/20 0.44
POLB P06746 1/20 0.44
KDM4E B2RXH2 4/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
HPGD P15428 2/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAPK1 P28482 1/20 0.38
CYP19A1 P11511 1/20 0.38
ATM Q13315 2/20 0.37

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
SCHEMBL14943815 0.85 LMNA (0.50) ALDH1A1MAPTHCRTR1L3MBTL1LMNA
SCHEMBL28837381 0.81 TSHR (0.53) ALDH1A1MAPTHCRTR1L3MBTL1LMNA
SCHEMBL14943816 0.80 ALDH1A1 (0.50) ALDH1A1MAPTHCRTR1L3MBTL1LMNA
SCHEMBL29589251 0.78 ALDH1A1 (0.48) ALDH1A1MAPTHCRTR1L3MBTL1LMNA
SCHEMBL300219 0.78 ALDH1A1 (0.48) ALDH1A1MAPTHCRTR1L3MBTL1LMNA
SCHEMBL31626799 0.78 ALDH1A1 (0.48) ALDH1A1MAPTHCRTR1L3MBTL1LMNA
SCHEMBL29456921 0.77 TSHR (0.57) ALDH1A1MAPTL3MBTL1LMNAPOLB
SCHEMBL51892 0.77 TSHR (0.57) ALDH1A1MAPTL3MBTL1LMNAPOLB
SCHEMBL28533855 0.77 MAPT (0.47) ALDH1A1MAPTHCRTR1L3MBTL1LMNA
Ammonia Solution, Strong SCHEMBL30382110 0.77 MAPT (0.47) ALDH1A1MAPTHCRTR1L3MBTL1LMNA

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
CN-100430385-C Compound for improving storage stability of photoinitiator and application thereof CIBA SC HOLDING AG (CH) 2008-11-05 CN disclosed
CN-1708488-A Improvement of storage stability of photoinitiators CIBA SC HOLDING AG (CH) 2005-12-14 CN disclosed