SCHEMBL9003136

NN=CN1CCC[C@@H](CNC(=O)C[C@H](NS(=O)(=O)N2CCOCC2)C(=O)N(CCNC(=O)/C(CCC(=O)O)=N\O)C2CC2)C1

nearest known ligand 0.36

Predicted protein targets (top 2)

	gene	UniProt	supporting neighbours	confidence
▸	F2	P00734	6/20	0.36

▸	REN	P00797	8/20	0.34

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
SCHEMBL9002936	0.91	F2 (0.35)	F2REN
SCHEMBL9003149	0.91	F2 (0.44)	F2REN
SCHEMBL9003129	0.91	F2 (0.44)	F2REN
SCHEMBL7391240	0.90	F2 (0.41)	F2REN
Acetic Acid SCHEMBL9002932	0.89	F2 (0.43)	F2REN
SCHEMBL7396514	0.85	F2 (0.41)	F2REN
Hydrochloric Acid SCHEMBL9002642	0.85	F2 (0.42)	F2REN
SCHEMBL7389705	0.84	F2 (0.38)	F2REN
SCHEMBL7392450	0.83	F2 (0.38)	F2REN
Acetic Acid SCHEMBL9003161	0.83	F2 (0.37)	F2REN

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-5559232-A	ANTICOAGULANTS	HOFFMANN-LA ROCHE INC. (US)	1996-09-24	—	—	US	disclosed