SCHEMBL28613334 — predicted protein targets

Predicted protein targets (top 8)

	gene	UniProt	supporting neighbours	confidence
▸	TRPA1	O75762	1/20	0.45

▸	RIPK1	Q13546	5/20	0.40

▸	KDM1A	O60341	2/20	0.33

▸	KDM1B	Q8NB78	1/20	0.33

▸	DPP4	P27487	5/20	0.33

▸	NTRK1	P04629	5/20	0.33

▸	JAK2	O60674	3/20	0.33

▸	KIF11	P52732	1/20	0.32

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
SCHEMBL28613335	1.00	TRPA1 (0.45)	TRPA1RIPK1KDM1AKDM1BDPP4
SCHEMBL28623840	0.76	DPP4 (0.38)	RIPK1KDM1AKDM1BDPP4NTRK1
SCHEMBL22013223	0.76	TRPA1 (0.44)	TRPA1RIPK1KDM1AKDM1BDPP4
SCHEMBL22013225	0.76	RIPK1 (0.38)	RIPK1KDM1AKDM1BDPP4NTRK1
SCHEMBL28623843	0.76	DPP4 (0.38)	RIPK1KDM1AKDM1BDPP4NTRK1
SCHEMBL23825285	0.76	RIPK1 (0.38)	RIPK1KDM1AKDM1BDPP4NTRK1
SCHEMBL29200705	0.76	RIPK1 (0.38)	RIPK1KDM1AKDM1BDPP4NTRK1
SCHEMBL21313037	0.72	NTRK1 (0.41)	NTRK1JAK2
SCHEMBL28306342	0.72	NTRK1 (0.35)	TRPA1RIPK1NTRK1JAK2KIF11
SCHEMBL15017030	0.72	RIPK1 (0.39)	RIPK1KDM1AKDM1BDPP4NTRK1

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
CN-113242857-A	Preparation and application of imidazo aromatic ring compounds	上海轶诺药业有限公司	2021-08-10	—	—	CN	disclosed