SCHEMBL5507340

SCHEMBL5507340

CC(=O)CC(=O)c1cc(C)ccc1N

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.49
NPC1 O15118 3/20 0.49
HTT P42858 2/20 0.49
MAPK1 P28482 1/20 0.49
KDM4E B2RXH2 5/20 0.43
HPGD P15428 4/20 0.43
ALDH1A1 P00352 3/20 0.43
HSD17B10 Q99714 3/20 0.43
RAB9A P51151 4/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
ALOX15 P16050 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
THRB P10828 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
POLB P06746 1/20 0.42
LMNA P02545 1/20 0.42
TSHR P16473 2/20 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
SCHEMBL29080415 0.84 MAPT (0.53) MAPTKDM4EHPGDALDH1A1HSD17B10
SCHEMBL9040295 0.81 MAPT (0.51) MAPTNPC1HTTMAPK1KDM4E
SCHEMBL9274950 0.81 MEN1 (0.61) MAPTNPC1HTTMAPK1KDM4E
SCHEMBL11575893 0.81 KEAP1 (0.58) MAPTKDM4EHPGDALDH1A1HSD17B10
SCHEMBL10964252 0.81 NOS2 (0.60) MAPTNPC1HTTMAPK1KDM4E
SCHEMBL11575664 0.81 KDM4E (0.58) MAPTNPC1HTTMAPK1KDM4E
SCHEMBL8323160 0.80 MAPT (0.44) MAPTNPC1HTTMAPK1KDM4E
SCHEMBL4187193 0.80 RAB9A (0.62) MAPTNPC1HTTKDM4EHPGD
SCHEMBL8397350 0.80 RAB9A (0.53) MAPTNPC1HTTMAPK1KDM4E
P-Xylene SCHEMBL11798546 0.80 MEN1 (0.59) MAPTNPC1HTTMAPK1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105579241-B Thermosensitive recording medium 王子控股株式会社 2018-10-16 CN disclosed
CN-104995033-B Thermosensitive recording medium 王子控股株式会社 2017-10-13 CN disclosed
WO-2012154880-A1 PROTEOSTASIS REGULATORS FOR TREATING CYSTIC FIBROSIS AND OTHER PROTEIN MISFOLDING DISEASES PROTEOSTASIS THERAPEUTICS, INC. (US) 2012-11-15 WO disclosed
EP-1771816-A1 A MULTIFUNCTION, DIRECT THERMAL RECORDING MATERIAL Kanzaki Specialty Papers Inc. (US) 2007-04-11 EP disclosed
WO-2006005000-A1 A MULTIFUNCTION, DIRECT THERMAL RECORDING MATERIAL KANZAKI SPECIALTY PAPERS INC. (US) 2006-01-12 WO disclosed
CN-1134517-C Disazo pigment composition and printing ink 3M 2004-01-14 CN disclosed
CN-1175607-A Tetrazo pigment composition and printing ink DAINIPPON INK & CHEMICALS (JP) 1998-03-11 CN disclosed
US-4169091-A Symmetrical and asymmetrical disazo compounds containing a bis-(nitro-aryloxy)alkane middle component HOECHST AKTIENGESELLSCHAFT (DE) 1979-09-25 US disclosed