SCHEMBL26169654

O=C(NCc1ccc(C(=O)NCc2ccc(C(=O)NCc3ccc(C(=O)ON4C(=O)CCC4=O)cc3S(=O)(=O)O)cc2S(=O)(=O)O)cc1S(=O)(=O)O)c1ccc(CNC(=O)C(F)(F)F)cc1

nearest known ligand 0.40

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	EPHX2	P34913	6/20	0.40

▸	NR1H4	Q96RI1	6/20	0.40

▸	L3MBTL1	Q9Y468	2/20	0.38

▸	ALDH1A1	P00352	2/20	0.36

▸	SMN1; SMN2	Q16637	1/20	0.36

▸	LMNA	P02545	1/20	0.36

▸	CNR2	P34972	2/20	0.36

▸	CNR1	P21554	1/20	0.36

▸	NAMPT	P43490	1/20	0.36

▸	MLYCD	O95822	1/20	0.36

▸	MAPT	P10636	1/20	0.36

▸	CA1	P00915	1/20	0.35

▸	CA2	P00918	1/20	0.35

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
SCHEMBL26169644	1.00	EPHX2 (0.40)	EPHX2NR1H4L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL26169643	0.82	NR1H4 (0.48)	EPHX2NR1H4MLYCDCA1CA2
SCHEMBL26169645	0.82	NR1H4 (0.48)	EPHX2NR1H4MLYCDCA1CA2
SCHEMBL26169655	0.82	NR1H4 (0.48)	EPHX2NR1H4MLYCDCA1CA2
SCHEMBL26169638	0.81	EPHX2 (0.49)	EPHX2NR1H4MLYCDCA1CA2
SCHEMBL26169637	0.81	EPHX2 (0.40)	EPHX2NR1H4LMNANAMPTMAPT
SCHEMBL13447354	0.76	CDK5 (0.33)	EPHX2NR1H4LMNA
SCHEMBL24002404	0.72	EPHX2 (0.45)	EPHX2NR1H4
SCHEMBL18056880	0.71	MEN1 (0.38)	ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL12993096	0.70	KMT2A (0.41)	EPHX2

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-20230160001-A1	NUCLEOTIDE CLEAVABLE LINKERS WITH RIGID SPACERS AND USES THEREOF	FIRST-CITIZENS BANK & TRUST COMPANY	2023-05-25	—	—	US	disclosed