SCHEMBL8697113

SCHEMBL8697113

CC(C)(C)OC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)OCc1ccccc1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 10/20 0.82
KLK7 P49862 1/20 0.69
CTSL P07711 2/20 0.68
CTSS P25774 1/20 0.68
CTSK P43235 1/20 0.68
ACE P12821 1/20 0.67
NMBR P28336 2/20 0.62
MAPT P10636 3/20 0.62
TP53 P04637 2/20 0.62
LNPEP Q9UIQ6 1/20 0.62
GAA P10253 1/20 0.62
HTT P42858 1/20 0.62
KLK5 Q9Y337 1/20 0.61
KDM4E B2RXH2 1/20 0.60
MEN1 O00255 1/20 0.60
ALDH1A1 P00352 1/20 0.60
LMNA P02545 1/20 0.60
CYP1A2 P05177 1/20 0.60
POLB P06746 1/20 0.60
CYP3A4 P08684 1/20 0.60

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
SCHEMBL16464197 1.00 TACR1 (0.82) TACR1KLK7CTSLCTSSCTSK
SCHEMBL5355362 1.00 TACR1 (0.82) TACR1KLK7CTSLCTSSCTSK
SCHEMBL29397912 1.00 TACR1 (0.82) TACR1KLK7CTSLCTSSCTSK
SCHEMBL27885257 0.96 TACR1 (0.77) TACR1KLK7CTSLCTSSCTSK
SCHEMBL27885259 0.96 TACR1 (0.77) TACR1KLK7CTSLCTSSCTSK
SCHEMBL27951091 0.94 TACR1 (0.74) TACR1KLK7CTSLCTSSCTSK
SCHEMBL27951092 0.94 TACR1 (0.74) TACR1KLK7CTSLCTSSCTSK
SCHEMBL27902191 0.94 TACR1 (0.73) TACR1KLK7CTSLCTSSCTSK
SCHEMBL27902193 0.94 TACR1 (0.73) TACR1KLK7CTSLCTSSCTSK
SCHEMBL16464707 0.93 TACR1 (0.71) TACR1KLK7CTSLCTSSCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3917576-A1 A CONJUGATE OF AN AMANITA TOXIN WITH BRANCHED LINKERS Hangzhou Dac Biotech Co., Ltd. (CN) 2021-12-08 EP disclosed
CN-113423430-A Amanitoxin conjugates containing branched linkers 杭州多禧生物科技有限公司 2021-09-21 CN disclosed
WO-2020155017-A1 A CONJUGATE OF AN AMANITA TOXIN WITH BRANCHED LINKERS HANGZHOU DAC BIOTECH CO., LTD (CN) 2020-08-06 WO disclosed
US-7253194-B2 Compounds and inhibitors of phospholipases THE UNIVERSITY OF QUEENSLAND (AU) 2007-08-07 US disclosed
US-5726319-A Biphenyl substituted dipeptide analogs promote release of growth hormone MERCK & CO., INC. (US) 1998-03-10 US disclosed
EP-0669830-A4 SUBSTITUTED DIPEPTIDE ANALOGS PROMOTE RELEASE OF GROWTH HORMONE. MERCK & CO INC (US) 1997-02-26 EP disclosed
EP-0669830-A1 SUBSTITUTED DIPEPTIDE ANALOGS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO. INC. (US) 1995-09-06 EP disclosed
WO-1994011012-A1 SUBSTITUTED DIPEPTIDE ANALOGS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1994-05-26 WO disclosed