SCHEMBL4014478

SCHEMBL4014478

CC(C)C(=O)Cc1nc2[nH]c(=O)[nH]c(=O)c2[nH]1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.40
ADORA2B P29275 1/20 0.38
XDH P47989 3/20 0.36
ENPP1 P22413 1/20 0.34
ACHE P22303 1/20 0.33
GDA Q9Y2T3 1/20 0.33
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32
MAPK1 P28482 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CYP1A2 P05177 1/20 0.31
HTT P42858 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
SCHEMBL7326384 0.83 MAPT (0.43) MAPTADORA2BXDHENPP1ACHE
SCHEMBL7326964 0.78 MAPT (0.42) MAPTADORA2BXDHENPP1ACHE
SCHEMBL60159 0.78 TSHR (0.46) MAPTADORA2BXDHENPP1ACHE
SCHEMBL380136 0.75 MAPT (0.48) MAPTADORA2BXDHACHEGDA
SCHEMBL31438586 0.75 MAPT (0.48) MAPTADORA2BXDHENPP1ACHE
SCHEMBL8700368 0.75 MAPT (0.42) MAPTADORA2BXDHENPP1ACHE
SCHEMBL541696 0.75 MAPT (0.42) MAPTADORA2BXDHACHEGDA
SCHEMBL3489066 0.74 HCAR2 (0.42) MAPTADORA2BXDHENPP1ACHE
SCHEMBL6268082 0.74 PNP (0.53) MAPTALDH1A1HPGDHSD17B10
SCHEMBL31265613 0.73 MAPT (0.40) MAPTADORA2BXDHENPP1ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114146229-A Preparation method of nanofiber scaffold and method for constructing tissue engineering material by adopting nanofiber scaffold and melanocytes 上海麦野生物科技有限公司 2022-03-08 CN disclosed
US-20090148546-A1 Methods and compounds fo rthe treatment of obesity and obesity-related disorders BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2009-06-11 US disclosed
US-7479540-B1 Adipomodulin and related molecules and methods PRASAD CHANDAN 2009-01-20 US disclosed
WO-2006086764-A2 METHODS AND COMPOUNDS FOR THE TREATMENT OF OBESITY AND OBESITY-RELATED DISORDERS THE BOARD OF SUPERVISOR OF LOUISIANA STATE UNIVERSITY AGRICULTURAL AND MECHANICAL COLLEGE (US) 2006-08-17 WO disclosed
US-20060182825-A1 Methods and compounds for the treatment of obesity and obesity-related disorders THE BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE 2006-08-17 US disclosed