SCHEMBL2012311

CCCCCCCC/C=C\CCCCCCCC(=O)C(OP(=O)(O)OCCN)[C@H](CO)OC(=O)CCCCCCCCCCC(N)C(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21

nearest known ligand 0.49

Predicted protein targets (top 19)

	gene	UniProt	supporting neighbours	confidence
▸	CNR2	P34972	2/20	0.49

▸	CNR1	P21554	3/20	0.48

▸	PLCD1	P51178	1/20	0.41

▸	TDP1	Q9NUW8	5/20	0.41

▸	HLCS	P50747	2/20	0.40

▸	F2	P00734	1/20	0.37

▸	PRSS1	P07477	1/20	0.37

▸	PRSS2	P07478	1/20	0.37

▸	PRSS3	P35030	1/20	0.37

▸	TPSAB1	Q15661	1/20	0.37

▸	MEN1	O00255	1/20	0.36

▸	ABL1	P00519	1/20	0.36

▸	LMNA	P02545	1/20	0.36

▸	PKM	P14618	1/20	0.36

▸	IDE	P14735	1/20	0.36

▸	MAPK1	P28482	1/20	0.36

▸	KMT2A	Q03164	1/20	0.36

▸	RIN1	Q13671	1/20	0.36

▸	L3MBTL1	Q9Y468	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
SCHEMBL30400770	0.85	CNR2 (0.57)	CNR2CNR1
SCHEMBL23521224	0.85	CNR2 (0.57)	CNR2CNR1
SCHEMBL29910361	0.85	CNR2 (0.57)	CNR2CNR1
SCHEMBL29429640	0.80	CNR2 (0.73)	CNR2CNR1TDP1HLCSMEN1
SCHEMBL9951988	0.80	S1PR1 (0.49)	—
SCHEMBL17595343	0.80	S1PR1 (0.49)	—
SCHEMBL2340054	0.80	S1PR1 (0.49)	—
SCHEMBL23142625	0.79	CNR2 (0.56)	CNR2CNR1
SCHEMBL23142658	0.79	CNR2 (0.58)	CNR2CNR1
SCHEMBL30824302	0.79	CNR2 (0.58)	CNR2CNR1

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
WO-2011066221-A1	IMMUNOGEN PRIORITIZATION FOR VACCINE DESIGN	INTERNATIONAL AIDS VACCINE INITIATIVE (US)	2011-06-03	—	—	WO	disclosed