SCHEMBL22249200

CC(C)(C)OC(=O)NC(C)(C)C(=O)N1CCN(C(=O)Nc2ccn(-c3ccc(CN4C[C@@H]5[C@H](C4)[C@H]5C(C)(C)NC(=O)OC(C)(C)C)cc3)c(=O)n2)CC1

nearest known ligand 0.34

Predicted protein targets (top 14)

	gene	UniProt	supporting neighbours	confidence
▸	FAAH	O00519	10/20	0.34

▸	JAK1	P23458	1/20	0.34

▸	ROCK2	O75116	3/20	0.33

▸	PRKAB2	O43741	2/20	0.33

▸	PRKAG1	P54619	2/20	0.33

▸	PRKAA2	P54646	2/20	0.33

▸	PRKAA1	Q13131	2/20	0.33

▸	PRKAG3	Q9UGI9	2/20	0.33

▸	PRKAG2	Q9UGJ0	2/20	0.33

▸	PRKAB1	Q9Y478	2/20	0.33

▸	ENPP2	Q13822	1/20	0.33

▸	NAMPT	P43490	2/20	0.32

▸	ALDH1A1	P00352	1/20	0.31

▸	MAPT	P10636	1/20	0.31

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.

Compound	similarity	top predicted	shared targets
SCHEMBL30276645	1.00	FAAH (0.34)	FAAHJAK1ROCK2PRKAB2PRKAG1
SCHEMBL22249207	0.93	JAK1 (0.36)	FAAHJAK1ROCK2PRKAB2PRKAG1
SCHEMBL30276467	0.93	JAK1 (0.36)	FAAHJAK1ROCK2PRKAB2PRKAG1
SCHEMBL28694755	0.91	NAMPT (0.36)	FAAHJAK1ROCK2PRKAB2PRKAG1
SCHEMBL30276499	0.90	JAK1 (0.32)	FAAHJAK1ROCK2ENPP2NAMPT
SCHEMBL30276619	0.90	FAAH (0.34)	FAAHJAK1ROCK2PRKAB2PRKAG1
SCHEMBL30276394	0.90	KCNK3 (0.38)	FAAHJAK1ENPP2NAMPTMAPT
SCHEMBL22249291	0.89	JAK1 (0.31)	FAAHJAK1ROCK2ENPP2
SCHEMBL22248809	0.87	JAK1 (0.36)	FAAHJAK1NAMPT
SCHEMBL30276507	0.87	JAK1 (0.36)	FAAHJAK1NAMPT

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
WO-2020150372-A1	ANTIMICROBIAL COMPOUNDS AND METHODS	CURZA GLOBAL, LLC (US)	2020-07-23	—	—	WO	disclosed