SCHEMBL28031723

SCHEMBL28031723

CC(=O)ON(C(N)=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.39
ALOX5 P09917 1/20 0.38
ALDH1A1 P00352 4/20 0.37
TSHR P16473 4/20 0.37
GLA P06280 1/20 0.37
TDP1 Q9NUW8 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
ATM Q13315 1/20 0.36
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36
NPC1 O15118 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
BLM P54132 2/20 0.35
HSD17B10 Q99714 2/20 0.35
POLB P06746 1/20 0.35
CYP3A4 P08684 1/20 0.35
PARP1 P09874 1/20 0.35

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
SCHEMBL11141452 0.84 NPSR1 (0.41) NPSR1ALOX5ALDH1A1TSHRGLA
SCHEMBL3279596 0.84 NPSR1 (0.41) NPSR1ALDH1A1TSHRGLATDP1
SCHEMBL27886540 0.82 TSHR (0.44) NPSR1ALOX5ALDH1A1TSHRGLA
SCHEMBL14166589 0.81 NPSR1 (0.39) NPSR1ALDH1A1TSHRGLATDP1
SCHEMBL28103373 0.80 ALDH1A1 (0.42) NPSR1ALOX5ALDH1A1TSHRGLA
SCHEMBL6037494 0.80 NPSR1 (0.41) NPSR1ALOX5ALDH1A1TSHRGLA
SCHEMBL27402792 0.79 LMNA (0.47) NPSR1ALDH1A1TSHRTDP1L3MBTL1
SCHEMBL4280295 0.79 SMN1; SMN2 (0.41) NPSR1ALOX5ALDH1A1TSHRGLA
SCHEMBL16416741 0.78 ALDH1A1 (0.43) NPSR1ALDH1A1TSHRGLAMTNR1A
SCHEMBL6505102 0.77 CES1 (0.37) NPSR1ALOX5ALDH1A1TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115185104-A Contact lens product 星欧光学股份有限公司 2022-10-14 CN disclosed
CN-103288793-B The Phenethanolamine derivative for the treatment of respiratory disease GLAXO GROUP LTD. (GB) 2015-09-23 CN disclosed