SCHEMBL7080287 — predicted protein targets

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	HSD11B1	P28845	17/20	0.52

▸	FBP1	P09467	1/20	0.39

▸	MEN1	O00255	1/20	0.37

▸	KMT2A	Q03164	1/20	0.37

▸	ALDH1A1	P00352	1/20	0.33

▸	NR1I2	O75469	1/20	0.33

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
SCHEMBL7082452	0.87	HSD11B1 (0.39)	HSD11B1MEN1KMT2AALDH1A1NR1I2
SCHEMBL7079599	0.87	HSD11B1 (0.52)	HSD11B1FBP1MEN1KMT2AALDH1A1
SCHEMBL7082940	0.86	HSD11B1 (0.51)	HSD11B1FBP1MEN1KMT2A
SCHEMBL7082944	0.86	HSD11B1 (0.51)	HSD11B1FBP1MEN1KMT2A
SCHEMBL7079650	0.85	FBP1 (0.41)	HSD11B1FBP1MEN1KMT2AALDH1A1
SCHEMBL7083524	0.76	HSD11B1 (0.57)	HSD11B1MEN1KMT2AALDH1A1NR1I2
SCHEMBL7079469	0.75	FBP1 (0.44)	HSD11B1FBP1
SCHEMBL7083810	0.74	HSD11B1 (0.33)	HSD11B1
SCHEMBL7083812	0.74	HSD11B1 (0.33)	HSD11B1
SCHEMBL6897706	0.70	HSD11B1 (0.62)	HSD11B1MEN1KMT2AALDH1A1NR1I2

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-2003064372-A1	2-ADAMANTYLALKYLAMINES AND THEIR USE IN THE TREATMENT OF CONDITIONS GENERALLY ASSOCIATED WITH ABNORMALITIES IN GLUTAMATERGIC TRANSMISSION	VERNALIS RESEARCH LIMITED (GB)	2003-08-07	—	—	WO	disclosed