SCHEMBL13754115 — predicted protein targets

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	CA2	P00918	13/20	0.58

▸	CA1	P00915	10/20	0.58

▸	CA4	P22748	8/20	0.58

▸	CA6	P23280	6/20	0.58

▸	PTPN1	P18031	1/20	0.39

▸	CA12	O43570	3/20	0.37

▸	CA9	Q16790	2/20	0.37

▸	PTGS2	P35354	1/20	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
SCHEMBL17910250	0.80	CA2 (0.55)	CA2CA1CA4CA6PTPN1
SCHEMBL5108696	0.80	GABRA1 (0.38)	CA2CA1CA4CA6PTPN1
SCHEMBL11103320	0.76	CA2 (0.52)	CA2CA1CA4CA6PTPN1
SCHEMBL3683190	0.76	GABRA1 (0.36)	CA2CA1CA4CA6PTPN1
SCHEMBL27853184	0.74	CA2 (1.00)	CA2CA1CA4CA6PTPN1
SCHEMBL2956027	0.74	PTGS2 (0.42)	CA2CA1CA4CA6PTGS2
SCHEMBL5109697	0.74	GABRA1 (0.35)	CA2CA1CA4CA6PTPN1
SCHEMBL5108761	0.74	GABRA1 (0.35)	CA2CA1CA4CA6PTPN1
SCHEMBL28669928	0.73	CA2 (0.48)	CA2CA1CA4CA6PTPN1
SCHEMBL5095740	0.73	GABRA1 (0.38)	—

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
US-7576117-B1	Cyclic amine CCR3 antagonist	TEIJIN LIMITED (JP)	2009-08-18	—	—	US	disclosed
US-7576117-B1	Cyclic amine CCR3 antagonist	TEIJIN LIMITED (JP)	2009-08-18	—	—	US	disclosed