SCHEMBL30822985 — predicted protein targets

Predicted protein targets (top 15)

	gene	UniProt	supporting neighbours	confidence
▸	ALOX15	P16050	1/20	0.45

▸	CA2	P00918	2/20	0.43

▸	CA12	O43570	1/20	0.43

▸	CA1	P00915	1/20	0.43

▸	CA9	Q16790	1/20	0.43

▸	CA14	Q9ULX7	1/20	0.43

▸	KDM5B	Q9UGL1	1/20	0.40

▸	FNTA	P49354	7/20	0.39

▸	FNTB	P49356	7/20	0.39

▸	ALDH1A1	P00352	1/20	0.39

▸	CES2	O00748	1/20	0.37

▸	CES1	P23141	1/20	0.37

▸	HTT	P42858	1/20	0.35

▸	LMNA	P02545	1/20	0.35

▸	HTR2A	P28223	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
SCHEMBL22231568	0.86	CES2 (0.48)	ALOX15CA2CA12CA1CA9
SCHEMBL2061275	0.82	ALOX15 (0.51)	ALOX15CA2CA12CA1CA9
SCHEMBL17205438	0.78	CES2 (0.50)	ALOX15CA2CA12CA1CA9
SCHEMBL7455336	0.78	PDE10A (0.43)	CES2CES1HTT
SCHEMBL7453388	0.77	GAA (0.52)	ALDH1A1CES2CES1
SCHEMBL29767472	0.76	ALOX15 (0.45)	ALOX15CA2CA12CA1CA9
SCHEMBL2062426	0.76	ALOX15 (0.48)	ALOX15CA2CA12CA1CA9
SCHEMBL26906942	0.76	ALOX15 (0.45)	ALOX15CA2CA12CA1CA9
SCHEMBL22231123	0.75	L3MBTL1 (0.50)	ALOX15CA2CA12CA1CA9
SCHEMBL27779848	0.74	GAA (0.58)	ALOX15ALDH1A1

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-2024002210-A1	AROMATIC AMIDE DERIVATIVE AND USE THEREOF IN ANTITUMOR DRUGS	上海喆邺生物科技有限公司	2024-01-04	—	—	WO	disclosed