SCHEMBL28829142

SCHEMBL28829142

CC(C)(C)OC(=O)NOC(=O)CC(O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.45
CTSS P25774 1/20 0.45
RIPK1 Q13546 1/20 0.43
BCAT2 O15382 1/20 0.41
MAPT P10636 1/20 0.40
PPARG P37231 3/20 0.40
PPARA Q07869 3/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA7 P43166 1/20 0.40
CA14 Q9ULX7 1/20 0.40
ATM Q13315 1/20 0.40
KLK5 Q9Y337 1/20 0.39
IDO1 P14902 1/20 0.39
PPARD Q03181 2/20 0.39

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
SCHEMBL28857505 0.84 RIPK1 (0.51) CTSKCTSSRIPK1BCAT2MAPT
SCHEMBL5654433 0.84 RIPK1 (0.51) CTSKCTSSRIPK1BCAT2MAPT
SCHEMBL5694863 0.80 CTSK (0.47) CTSKCTSSRIPK1BCAT2MAPT
SCHEMBL9420598 0.78 RIPK1 (0.46) CTSKCTSSRIPK1BCAT2MAPT
SCHEMBL18921533 0.78 RIPK1 (0.50) CTSKCTSSRIPK1BCAT2MAPT
SCHEMBL22456387 0.78 RIPK1 (0.50) CTSKCTSSRIPK1BCAT2MAPT
SCHEMBL22232743 0.78 RIPK1 (0.50) CTSKCTSSRIPK1BCAT2MAPT
SCHEMBL1948655 0.77 CA12 (0.50) CTSKCTSSPPARGPPARACA12
SCHEMBL350453 0.77 NPC1 (0.58) CTSKCTSSRIPK1BCAT2ATM
SCHEMBL1624911 0.77 NPC1 (0.58) CTSKCTSSRIPK1BCAT2ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109867630-A - 1 receptor modulators of novel glp-1 赛尔基因第二国际有限公司 2019-06-11 CN disclosed
CN-105593225-B novel GLP-1 receptor modulators 赛尔基因第二国际有限公司 2019-04-16 CN disclosed
CN-105593225-A Novel GLP-1 receptor modulators RECEPTOS INC 2016-05-18 CN disclosed