SCHEMBL1828644

SCHEMBL1828644

CCOC(=O)C(=O)Oc1ccccc1C(=O)NN

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.59
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
HCRTR1 O43613 2/20 0.48
TSHR P16473 1/20 0.46
MAPT P10636 3/20 0.44
PLIN1 O60240 1/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
PLIN5 Q00G26 1/20 0.44
ABHD5 Q8WTS1 1/20 0.44
ALDH1A1 P00352 2/20 0.44
HSD17B10 Q99714 1/20 0.44
KDM4E B2RXH2 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
P2RX7 Q99572 1/20 0.43
GAA P10253 2/20 0.43
MAPK1 P28482 1/20 0.43

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
SCHEMBL7748621 0.89 CTSD (0.68) CTSDMEN1KMT2AHCRTR1TSHR
SCHEMBL3234187 0.81 CTSD (0.62) CTSDMEN1KMT2AHCRTR1TSHR
SCHEMBL28767126 0.80 CTSD (0.65) CTSDMEN1KMT2AHCRTR1ALDH1A1
SCHEMBL2358299 0.79 HCRTR1 (0.73) CTSDMEN1KMT2AHCRTR1TSHR
SCHEMBL12468767 0.79 CTSD (0.69) CTSDMEN1KMT2AHCRTR1TSHR
SCHEMBL11326953 0.77 CTSD (0.66) CTSDMEN1KMT2AHCRTR1TSHR
SCHEMBL17479848 0.77 CTSD (0.66) CTSDMEN1KMT2AHCRTR1TSHR
SCHEMBL30349208 0.75 CTSD (1.00) CTSDMEN1KMT2ATSHRMAPT
SCHEMBL295407 0.75 CTSD (1.00) CTSDMEN1KMT2ATSHRMAPT
SCHEMBL6329484 0.75 CTSD (0.72) CTSDMEN1KMT2AHCRTR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020016279-A1 Enzymatic oxidation composition and process UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-02-07 US claimed
EP-2318522-A1 CLEANING AND/OR TREATMENT COMPOSITIONS The Procter & Gamble Company (US) 2011-05-11 EP disclosed
US-20100055768-A1 CLEANING AND/OR TREATMENT COMPOSITIONS THE PROCTER & GAMBLE COMPANY 2010-03-04 US disclosed
US-6689738-B2 ANTISOILANTS, BLEACHING UNILEVER HOME AND PERSONAL CARE USA DIVISION OF CONOPCO, INC. 2004-02-10 US disclosed
US-20020119900-A1 Oxidation process and composition UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-08-29 US disclosed
US-20020016279-A1 Enzymatic oxidation composition and process UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-02-07 US disclosed