Formic Acid

SCHEMBL5562792

CN1C[C@@H]2C[C@H]1CN2C(=O)c1n[nH]c2cc(OC(F)F)ccc12.O=CO

nearest known ligand 0.39

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	DYRK1A	Q13627	13/20	0.39

▸	GSK3B	P49841	11/20	0.39

▸	JAK2	O60674	4/20	0.34

▸	JAK1	P23458	4/20	0.34

▸	CLK2	P49760	1/20	0.33

▸	CLK3	P49761	1/20	0.33

▸	TYK2	P29597	2/20	0.33

▸	JAK3	P52333	2/20	0.33

▸	LRRK2	Q5S007	1/20	0.33

▸	RBP4	P02753	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
SCHEMBL1176208	0.96	DYRK1A (0.41)	DYRK1AGSK3BJAK2JAK1CLK2
SCHEMBL5039120	0.96	DYRK1A (0.41)	DYRK1AGSK3BJAK2JAK1CLK2
Formic Acid SCHEMBL5556601	0.93	GSK3B (0.43)	DYRK1AGSK3BCLK2CLK3LRRK2
Formic Acid SCHEMBL5556201	0.90	TRPA1 (0.36)	GSK3BJAK2JAK1TYK2JAK3
Formic Acid SCHEMBL5562459	0.90	GSK3B (0.41)	DYRK1AGSK3BRBP4
SCHEMBL1176146	0.89	GSK3B (0.46)	DYRK1AGSK3BCLK2CLK3LRRK2
SCHEMBL5048308	0.89	GSK3B (0.46)	DYRK1AGSK3BCLK2CLK3LRRK2
Formic Acid SCHEMBL5562066	0.86	DYRK1A (0.35)	DYRK1AGSK3BCLK2CLK3
SCHEMBL1176642	0.86	TRPA1 (0.39)	GSK3BJAK2JAK1TYK2JAK3
SCHEMBL5046515	0.86	TRPA1 (0.39)	GSK3BJAK2JAK1TYK2JAK3

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
EP-1697378-B1	INDOLES, 1H-INDAZOLES, 1,2-BENZISOXAZOLES, AND 1,2-BENZISOTHIAZOLES, AND PREPARATION AND USES THEREOF	MEMORY PHARM CORP (US)	2007-11-21	—	—	EP	claimed