SCHEMBL11049544

SCHEMBL11049544

CCCOCCN(CC)c1cccc(NC(C)=O)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
POLB P06746 1/20 0.46
NR4A1 P22736 1/20 0.46
RAB9A P51151 1/20 0.46
MAPT P10636 2/20 0.45
ALDH1A1 P00352 4/20 0.44
TSHR P16473 2/20 0.44
USP2 O75604 1/20 0.44
TP53 P04637 1/20 0.44
PKM P14618 1/20 0.44
MAPK1 P28482 1/20 0.44
MCL1 Q07820 1/20 0.44
NOX1 Q9Y5S8 1/20 0.44
HSD17B10 Q99714 2/20 0.43
HPGD P15428 2/20 0.43
CYP1A2 P05177 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CSNK2A1 P68400 1/20 0.41
HTR7 P34969 1/20 0.40

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
SCHEMBL11054158 0.91 MEN1 (0.54) MEN1KMT2APOLBNR4A1RAB9A
SCHEMBL11051618 0.87 POLB (0.48) MEN1KMT2APOLBNR4A1RAB9A
SCHEMBL11693697 0.87 RAB9A (0.53) MEN1KMT2APOLBNR4A1RAB9A
SCHEMBL11049552 0.86 RAB9A (0.47) MEN1KMT2APOLBNR4A1RAB9A
SCHEMBL11225999 0.86 MEN1 (0.57) MEN1KMT2APOLBNR4A1RAB9A
SCHEMBL8394565 0.84 POLB (0.50) MEN1KMT2APOLBNR4A1RAB9A
SCHEMBL11049540 0.84 RAB9A (0.48) MEN1KMT2APOLBNR4A1RAB9A
SCHEMBL11520788 0.84 MEN1 (0.46) MEN1KMT2APOLBNR4A1RAB9A
SCHEMBL697935 0.84 ALDH1A1 (0.58) MEN1KMT2APOLBNR4A1RAB9A
SCHEMBL29594409 0.84 ALDH1A1 (0.58) MEN1KMT2APOLBNR4A1RAB9A

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-4456551-A Azo dyes from 2-amino-5-alkylthio-1,3,4-thiadiazoles and N-acyloxyalkyl-m-acylamidoanilines EASTMAN KODAK COMPANY (US) 1984-06-26 US disclosed