SCHEMBL10024014 — predicted protein targets

Predicted protein targets (top 16)

	gene	UniProt	supporting neighbours	confidence
▸	THRB	P10828	3/20	0.43

▸	RARB	P10826	4/20	0.38

▸	RARA	P10276	2/20	0.35

▸	RARG	P13631	1/20	0.35

▸	S1PR1	P21453	2/20	0.34

▸	S1PR3	Q99500	2/20	0.34

▸	TSHR	P16473	4/20	0.34

▸	HPGD	P15428	1/20	0.34

▸	FFAR4	Q5NUL3	4/20	0.33

▸	ALDH1A1	P00352	3/20	0.33

▸	TP53	P04637	2/20	0.33

▸	HIF1A	Q16665	2/20	0.33

▸	FFAR1	O14842	2/20	0.33

▸	CYP3A4	P08684	1/20	0.33

▸	HSD17B10	Q99714	1/20	0.33

▸	MET	P08581	1/20	0.32

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
SCHEMBL803177	0.94	THRB (0.49)	THRBRARBRARARARGS1PR1
SCHEMBL10040733	0.93	THRB (0.46)	THRBRARBRARARARGS1PR1
SCHEMBL22600352	0.89	THRB (0.43)	THRBRARBRARARARGS1PR1
SCHEMBL20342980	0.88	THRB (0.46)	THRBRARBRARARARGS1PR1
SCHEMBL18436414	0.88	APP (0.43)	THRBRARBRARARARGS1PR1
SCHEMBL19721881	0.87	RARB (0.39)	THRBRARBRARARARGS1PR1
SCHEMBL18511295	0.87	THRB (0.49)	THRBRARBRARARARGS1PR1
SCHEMBL20821885	0.86	THRB (0.40)	THRBRARBRARARARGS1PR1
SCHEMBL22600355	0.86	THRB (0.46)	THRBRARBRARARARGS1PR1
SCHEMBL19624228	0.86	THRB (0.40)	THRBRARBRARARARGS1PR1

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-2012022391-A2	POLYMERIZABLE MIXTURES AND THE USE THEREOF IN LIQUID CRYSTAL DISPLAYS	MERCK PATENT GMBH (DE)	2012-02-23	—	—	WO	disclosed