SCHEMBL25078629 — predicted protein targets

Predicted protein targets (top 15)

	gene	UniProt	supporting neighbours	confidence
▸	KDM4E	B2RXH2	2/20	0.39

▸	ALDH1A1	P00352	1/20	0.39

▸	ERN1	O75460	3/20	0.38

▸	PTPN1	P18031	1/20	0.38

▸	NFE2L2	Q16236	2/20	0.33

▸	GRIN2D	O15399	2/20	0.33

▸	GRIN3B	O60391	2/20	0.33

▸	GRIN1	Q05586	2/20	0.33

▸	GRIN2A	Q12879	2/20	0.33

▸	GRIN2B	Q13224	2/20	0.33

▸	GRIN2C	Q14957	2/20	0.33

▸	GRIN3A	Q8TCU5	2/20	0.33

▸	CES2	O00748	2/20	0.32

▸	CES1	P23141	2/20	0.32

▸	TDP1	Q9NUW8	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
SCHEMBL25078545	0.76	TDP1 (0.55)	KDM4EALDH1A1ERN1PTPN1TDP1
SCHEMBL29957006	0.73	ERN1 (0.46)	KDM4EALDH1A1ERN1PTPN1NFE2L2
SCHEMBL4363014	0.73	ERN1 (0.46)	KDM4EALDH1A1ERN1PTPN1NFE2L2
SCHEMBL29956453	0.72	TYR (0.52)	KDM4EALDH1A1ERN1
SCHEMBL172942	0.72	TYR (0.52)	KDM4EALDH1A1ERN1
SCHEMBL13863241	0.72	CA9 (0.48)	KDM4EALDH1A1NFE2L2GRIN2DGRIN3B
SCHEMBL29824365	0.72	NFE2L2 (0.54)	KDM4EALDH1A1ERN1PTPN1NFE2L2
Water SCHEMBL28915146	0.72	ERN1 (0.45)	KDM4EALDH1A1ERN1PTPN1NFE2L2
SCHEMBL96915	0.72	NFE2L2 (0.54)	KDM4EALDH1A1ERN1PTPN1NFE2L2
SCHEMBL18181691	0.72	KDM4E (0.44)	KDM4EALDH1A1ERN1PTPN1NFE2L2

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-2023022497-A1	SOS1 INHIBITOR AND USE THEREOF	주식회사 카나프테라퓨틱스	2023-02-23	—	—	WO	disclosed