SCHEMBL10168449

CCC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(C)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O)OC(C)=O

nearest known ligand 0.44

Predicted protein targets (top 20)

	gene	UniProt	supporting neighbours	confidence
▸	TSHR	P16473	2/20	0.44

▸	CHRM2	P08172	1/20	0.44

▸	CHRM4	P08173	1/20	0.44

▸	CHRM1	P11229	1/20	0.44

▸	TBXA2R	P21731	1/20	0.44

▸	SMN1; SMN2	Q16637	2/20	0.42

▸	GALR3	O60755	1/20	0.42

▸	MAPT	P10636	1/20	0.42

▸	BLM	P54132	1/20	0.42

▸	LMNA	P02545	2/20	0.34

▸	MEN1	O00255	1/20	0.34

▸	CYP1A2	P05177	1/20	0.34

▸	HRH1	P35367	1/20	0.34

▸	KMT2A	Q03164	1/20	0.34

▸	SLC18A3	Q16572	1/20	0.33

▸	PRKCA	P17252	2/20	0.33

▸	ALOX15	P16050	1/20	0.32

▸	TRPV1	Q8NER1	1/20	0.30

▸	ALDH1A1	P00352	1/20	0.30

▸	HSD17B10	Q99714	1/20	0.30

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
SCHEMBL15725513	1.00	TSHR (0.44)	TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL19760880	1.00	TSHR (0.44)	TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL10065668	0.96	TSHR (0.47)	TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL17358635	0.92	TSHR (0.50)	TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL15905907	0.84	TSHR (0.33)	TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL28464334	0.84	TSHR (0.39)	TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL26338531	0.84	TSHR (0.39)	TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL15500033	0.83	TSHR (0.40)	TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL19779092	0.83	TSHR (0.33)	TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL14088060	0.81	TSHR (0.44)	TSHRCHRM2CHRM4CHRM1TBXA2R

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
US-20120021358-A1	PROCESS FOR MAKING LITHOGRAPHIC PRINTING PLATE, DEVELOPER FOR LITHOGRAPHIC PRINTING PLATE PRECURSOR, AND REPLENISHER FOR LITHOGRAPHIC PRINTING PLATE PRECURSOR DEVELOPMENT	FUJIFILM CORPORATION (JP)	2012-01-26	—	—	US	disclosed