Triethyl Citrate

SCHEMBL8105467

CCCCOC(C(=O)O)(C(CCCC)C(=O)O)C(CCCC)(C(C)=O)C(=O)O.CCOC(=O)CC(O)(CC(=O)OCC)C(=O)OCC

nearest known ligand 0.35

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	MEN1	O00255	2/20	0.35

▸	KMT2A	Q03164	2/20	0.35

▸	HPGD	P15428	1/20	0.35

▸	RECQL	P46063	1/20	0.35

▸	HSD17B10	Q99714	1/20	0.35

▸	HSPD1	P10809	1/20	0.33

▸	BLM	P54132	1/20	0.33

▸	HSPE1	P61604	1/20	0.33

▸	MAPT	P10636	1/20	0.31

▸	ATM	Q13315	1/20	0.31

▸	L3MBTL1	Q9Y468	1/20	0.31

▸	USP2	O75604	1/20	0.30

▸	LMNA	P02545	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
SCHEMBL686374	0.85	HSPD1 (0.37)	MEN1KMT2AHPGDRECQLHSD17B10
SCHEMBL16319164	0.76	HSPD1 (0.44)	MEN1KMT2AHPGDRECQLHSD17B10
Triethyl Citrate SCHEMBL30689845	0.76	MEN1 (0.39)	MEN1KMT2AHPGDRECQLHSD17B10
Tributyl Citrate SCHEMBL29896783	0.71	MEN1 (0.37)	MEN1KMT2AHPGDRECQLHSD17B10
SCHEMBL9400013	0.71	HSPD1 (0.38)	MEN1KMT2AHPGDRECQLHSD17B10
Tributyl Citrate SCHEMBL29372408	0.71	MEN1 (0.39)	MEN1KMT2AHPGDRECQLHSD17B10
Tributyl Citrate SCHEMBL28094357	0.71	—	—
SCHEMBL31635427	0.70	NAAA (0.43)	MEN1KMT2AHPGDMAPTATM
SCHEMBL591738	0.70	HSPD1 (0.34)	MEN1KMT2AHPGDRECQLHSD17B10
SCHEMBL6663512	0.69	HSPD1 (0.37)	MEN1KMT2AHPGDRECQLHSD17B10

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-6110447-A	MIXTURES WITH SULFONAMIDES	L'OREAL (FR)	2000-08-29	—	—	US	claimed