SCHEMBL4879758

SCHEMBL4879758

CC(N)C(=O)c1cccc(O)c1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TERT O14746 2/20 0.43
ALOX5 P09917 2/20 0.43
DBH P09172 2/20 0.42
G6PD P11413 1/20 0.41
CASP7 P55210 1/20 0.41
CASP6 P55212 1/20 0.41
ALDH1A1 P00352 3/20 0.41
HPGD P15428 3/20 0.41
HSD17B10 Q99714 3/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
LMNA P02545 2/20 0.41
ADAMTS4 O75173 1/20 0.41
EGFR P00533 1/20 0.41
FYN P06241 1/20 0.41
MMP2 P08253 1/20 0.41
MMP9 P14780 1/20 0.41
ALOX15 P16050 1/20 0.41
MMP8 P22894 1/20 0.41

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
SCHEMBL15981547 0.84 TERT (0.46) TERTALOX5DBHALDH1A1HPGD
SCHEMBL7618886 0.78 TERT (0.45) TERTALOX5DBHG6PDCASP7
Pyrogallol SCHEMBL28301773 0.78 CA1 (0.52) DBHG6PDCASP7CASP6ALDH1A1
SCHEMBL3802912 0.78 G6PD (0.36) G6PDCASP7CASP6ALDH1A1HPGD
SCHEMBL3802910 0.78 G6PD (0.36) G6PDCASP7CASP6ALDH1A1HPGD
SCHEMBL28001986 0.77 KDM4E (0.42) TERTALOX5DBHG6PDCASP7
SCHEMBL20026813 0.77 TERT (0.44) TERTALOX5HSD17B10CA1CA2
SCHEMBL29425312 0.75 TERT (0.42) TERTALOX5G6PDCASP7CASP6
SCHEMBL6069780 0.75 KDM4E (0.49) TERTALOX5DBHG6PDCASP7
Hydrochloric Acid SCHEMBL11272618 0.74 GAA (0.44) DBHCASP7ALDH1A1HSD17B10TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210205238-A1 STABILIZED INJECTABLE PHARMACEUTICAL COMPOSITION OF L-EPINEPHRINE MERCK PATENT GMBH (DE) 2021-07-08 US disclosed
EP-3694501-A1 STABILIZED INJECTABLE PHARMACEUTICAL COMPOSITIONS OF L-EPINEPHRINE Merck Patent GmbH (DE) 2020-08-19 EP disclosed
CN-111163764-A Stabilized injectable pharmaceutical compositions of L-epinephrine 默克专利股份公司 2020-05-15 CN disclosed
WO-2019072723-A1 STABILIZED INJECTABLE PHARMACEUTICAL COMPOSITIONS OF L-EPINEPHRINE MERCK PATENT GMBH (DE) 2019-04-18 WO disclosed
US-20080269347-A1 EPINEPHRINE FORMULATIONS AZOPHARMA, INC. 2008-10-30 US disclosed