Trifluoroacetic Acid

SCHEMBL8552693

CC(C)(C)OC(=O)N1CCC(CCCc2ccc3[nH]c(COc4ccc(Cl)cc4)nc3c2OCC2CCCCC2)CC1.O=C(O)C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	CHEK2	O96017	2/20	0.40

▸	PRMT5	O14744	4/20	0.39

▸	GPR119	Q8TDV5	7/20	0.39

▸	DGAT2	Q96PD7	1/20	0.38

▸	NPY1R	P25929	2/20	0.37

▸	ALOX5AP	P20292	1/20	0.36

▸	FEN1	P39748	1/20	0.36

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
Trifluoroacetic Acid SCHEMBL8552332	0.92	PRMT5 (0.40)	CHEK2PRMT5GPR119DGAT2NPY1R
Trifluoroacetic Acid SCHEMBL8555305	0.90	PRMT5 (0.40)	CHEK2PRMT5GPR119DGAT2NPY1R
SCHEMBL8553734	0.89	GPR119 (0.42)	CHEK2PRMT5GPR119DGAT2NPY1R
Trifluoroacetic Acid SCHEMBL8555259	0.87	RHEB (0.38)	CHEK2DGAT2NPY1R
SCHEMBL8557780	0.87	GPR119 (0.44)	CHEK2PRMT5GPR119DGAT2NPY1R
SCHEMBL8556312	0.87	PRMT5 (0.51)	PRMT5GPR119NPY1R
SCHEMBL8553086	0.86	GPR119 (0.44)	CHEK2PRMT5GPR119DGAT2
SCHEMBL8555211	0.84	GPR119 (0.45)	CHEK2PRMT5GPR119DGAT2NPY1R
SCHEMBL8555907	0.83	CHEK2 (0.43)	CHEK2PRMT5GPR119DGAT2ALOX5AP
SCHEMBL8555463	0.82	GPR119 (0.40)	CHEK2PRMT5GPR119DGAT2NPY1R

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-0871442-A1	BENZIMIDZOLYL NEUROPEPTIDE Y RECEPTOR ANTAGONISTS	ELI LILLY AND COMPANY (US)	1998-10-21	—	—	EP	disclosed
WO-1997025041-A1	BENZIMIDZOLYL NEUROPEPTIDE Y RECEPTOR ANTAGONISTS	ELI LILLY AND COMPANY (US)	1997-07-17	—	—	WO	disclosed