SCHEMBL4669907

NC(=O)Nc1ccc(Cl)cc1C(=O)NCC(=O)N[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccc(Cl)cc1.O=C(CNC(=O)C1c2cc(Cl)ccc2Oc2ccc(Cl)cc21)N[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccc(Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	CCR2	P41597	11/20	0.46

▸	CCR1	P32246	1/20	0.39

▸	MCHR1	Q99705	2/20	0.38

▸	MAPT	P10636	1/20	0.38

▸	MAPK1	P28482	1/20	0.38

▸	CXCR6	O00574	1/20	0.37

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
SCHEMBL4669911	1.00	CCR2 (0.46)	CCR2CCR1MCHR1MAPTMAPK1
SCHEMBL3869050	0.89	CCR2 (0.53)	CCR2MAPTMAPK1CXCR6
SCHEMBL3869053	0.89	CCR2 (0.53)	CCR2MAPTMAPK1CXCR6
SCHEMBL3871378	0.88	CCR1 (0.47)	CCR2CCR1MAPTMAPK1CXCR6
SCHEMBL3871380	0.88	CCR1 (0.47)	CCR2CCR1MAPTMAPK1CXCR6
SCHEMBL3869989	0.82	MAPK1 (0.46)	CCR2CCR1MAPTMAPK1CXCR6
SCHEMBL3869991	0.82	MAPK1 (0.46)	CCR2CCR1MAPTMAPK1CXCR6
SCHEMBL4668373	0.81	CCR1 (0.41)	CCR2CCR1MAPTMAPK1CXCR6
SCHEMBL4668371	0.81	CCR1 (0.41)	CCR2CCR1MAPTMAPK1CXCR6
SCHEMBL4182888	0.77	CCR2 (0.69)	CCR2CXCR6

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-1891064-A1	N-AMIDE DERIVATIVES OF 8-AZABICYCLO[3.2.1]OCT-3-YL AS CCR1 ANTAGONISTS	Laboratorios Almirall, S.A. (ES)	2008-02-27	—	—	EP	disclosed
WO-2006133802-A1	N-AMIDE DERIVATIVES OF 8-AZABICYCLO[3.2.1]OCT-3-YL AS CCR1 ANTAGONISTS	LABORATORIOS ALMIRALL, S.A. (ES)	2006-12-21	—	—	WO	disclosed