SCHEMBL2651083

Cc1ccc(NC(=O)Nc2ncc(Cc3nc(C(=O)O)co3)s2)c(N2CCCCC2)c1.Cc1ccc(NC(=O)Nc2ncc(Cc3nc4ccccc4[nH]3)s2)c(N2CCCCC2)c1

nearest known ligand 0.37

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	NTRK1	P04629	4/20	0.37

▸	USP2	O75604	1/20	0.37

▸	DRD4	P21917	1/20	0.37

▸	HPGD	P15428	1/20	0.36

▸	NTRK2	Q16620	2/20	0.36

▸	OGA	O60502	1/20	0.34

▸	SLC40A1	Q9NP59	3/20	0.34

▸	POLB	P06746	1/20	0.34

▸	METAP1	P53582	1/20	0.33

▸	SMN1; SMN2	Q16637	2/20	0.33

▸	PKM	P14618	1/20	0.33

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
SCHEMBL1343593	0.92	DRD4 (0.43)	NTRK1USP2DRD4HPGDNTRK2
SCHEMBL1343533	0.89	POLB (0.40)	POLBSMN1; SMN2
SCHEMBL2651080	0.88	NTRK1 (0.33)	NTRK1USP2DRD4HPGDNTRK2
SCHEMBL1343359	0.85	NTRK1 (0.48)	NTRK1USP2DRD4NTRK2POLB
SCHEMBL1340733	0.84	POLB (0.39)	POLBSMN1; SMN2
SCHEMBL1343567	0.82	POLB (0.38)	DRD4HPGDPOLB
SCHEMBL1340705	0.81	POLB (0.39)	POLBSMN1; SMN2
SCHEMBL1343447	0.79	POLB (0.39)	POLBSMN1; SMN2
SCHEMBL1344050	0.78	NPSR1 (0.43)	HPGDPOLBMETAP1
SCHEMBL1342123	0.76	MAPT (0.40)	POLBSMN1; SMN2

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-1531815-A1	GLUCOKINASE ACTIVATORS	NOVO NORDISK A/S (DK)	2005-05-25	—	—	EP	disclosed
WO-2004002481-A1	ARYL CARBONYL DERIVATIVES AS THERAPEUTIC AGENTS	NOVO NORDISK A/S (DK)	2004-01-08	—	—	WO	disclosed