SCHEMBL19974305

SCHEMBL19974305

CCOC(=O)CC(C)NC(=O)NN

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.43
GAA P10253 1/20 0.43
SI P14410 1/20 0.43
MGAM2 Q2M2H8 1/20 0.43
ALOX15 P16050 3/20 0.39
CYP2D6 P10635 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 4/20 0.36
TRPA1 O75762 1/20 0.36
CYP1A2 P05177 1/20 0.36
KMT2A Q03164 2/20 0.35
CYP3A4 P08684 2/20 0.35
POLB P06746 1/20 0.35
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CHRM1 P11229 1/20 0.34
ADORA1 P30542 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KDM4E B2RXH2 2/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL1912643 0.81 ALOX15 (0.46) MGAMGAASIMGAM2ALOX15
SCHEMBL1405629 0.79 MGAM (0.48) MGAMGAASIMGAM2ALOX15
SCHEMBL22246440 0.79 MGAM (0.48) MGAMGAASIMGAM2ALOX15
SCHEMBL13356642 0.79 MGAM (0.48) MGAMGAASIMGAM2ALOX15
SCHEMBL10362612 0.79 DPP4 (0.43) MGAMGAASIMGAM2ALOX15
SCHEMBL10362613 0.79 DPP4 (0.43) MGAMGAASIMGAM2ALOX15
SCHEMBL25974903 0.78 GAA (0.46) MGAMGAASIMGAM2ALOX15
SCHEMBL14521536 0.78 MGAM (0.46) MGAMGAASIMGAM2ALOX15
SCHEMBL8972157 0.78 MGAM (0.46) MGAMGAASIMGAM2ALOX15
SCHEMBL7835239 0.75 GAA (0.52) MGAMGAASIMGAM2ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3512486-B1 BLUE POWDER AND USE THEREOF IN COSMETICS OREAL (FR) 2020-10-21 EP disclosed
CN-105073757-B Dyeing process using a hair-dyeing precursor obtained from an iridoid, composition, precursor and device comprising such a precursor 莱雅公司 2019-12-17 CN disclosed
EP-3512486-A1 BLUE POWDER AND USE THEREOF IN COSMETICS L'Oreal (FR) 2019-07-24 EP disclosed
WO-2018050504-A1 BLUE POWDER AND USE THEREOF IN COSMETICS L'OREAL (FR) 2018-03-22 WO disclosed