Ether

Ether

SCHEMBL28852012

CCOCC.NC(=O)c1ccccc1C(N)=O

nearest known ligand 0.63

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.52
KDM4E B2RXH2 5/20 0.50
ALDH1A1 P00352 3/20 0.50
HSD17B10 Q99714 3/20 0.50
MAPT P10636 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
NR1I2 O75469 1/20 0.50
LMNA P02545 1/20 0.50
CHRM2 P08172 1/20 0.50
CYP3A4 P08684 1/20 0.50
ADRA2A P08913 1/20 0.50
OPRK1 P41145 1/20 0.50
HTR2B P41595 1/20 0.50
SLC6A3 Q01959 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
HPGD P15428 1/20 0.50
IRAK4 Q9NWZ3 1/20 0.48
METAP2 P50579 1/20 0.47
HTT P42858 1/20 0.46

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
Alcohol SCHEMBL8861714 0.84 KDM4E (0.56) TSHRKDM4EALDH1A1HSD17B10MAPT
SCHEMBL6888975 0.82 TSHR (0.81) TSHRKDM4EALDH1A1HSD17B10MAPT
Benzamide SCHEMBL4408659 0.81 PARP1 (0.67) TSHRALDH1A1HSD17B10MAPTMEN1
SCHEMBL39118 0.81 ALDH1A1 (0.70) TSHRKDM4EALDH1A1HSD17B10MAPT
SCHEMBL4967588 0.81 ALDH1A1 (0.70) TSHRKDM4EALDH1A1HSD17B10MAPT
SCHEMBL27700719 0.81 ALDH1A1 (0.70) TSHRKDM4EALDH1A1HSD17B10MAPT
Phthalic Acid SCHEMBL45284 0.80 ALDH1A1 (0.64) TSHRKDM4EALDH1A1HSD17B10MAPT
SCHEMBL1829556 0.80 LMNA (0.60) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL28712501 0.80 KMT2A (0.45) TSHRKDM4EALDH1A1HSD17B10MAPT
SCHEMBL8658655 0.80 MEN1 (0.42) TSHRKDM4EALDH1A1HSD17B10MAPT

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
CN-217489519-U Intracranial balloon dilatation catheter 心凯诺医疗科技(上海)有限公司 2022-09-27 CN claimed