SCHEMBL25844223 — predicted protein targets

Predicted protein targets (top 13)

	gene	UniProt	supporting neighbours	confidence
▸	TYMS	P04818	1/20	0.39

▸	PDK2	Q15119	16/20	0.33

▸	ALDH1A1	P00352	2/20	0.33

▸	TSHR	P16473	2/20	0.33

▸	MAPK1	P28482	2/20	0.33

▸	HSD17B10	Q99714	2/20	0.33

▸	TP53	P04637	1/20	0.33

▸	HPGD	P15428	1/20	0.33

▸	CASP1	P29466	1/20	0.33

▸	CASP7	P55210	1/20	0.33

▸	HIF1A	Q16665	1/20	0.33

▸	ATM	Q13315	1/20	0.32

▸	L3MBTL1	Q9Y468	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
SCHEMBL25844412	0.97	TYMS (0.41)	TYMSPDK2ALDH1A1TSHRMAPK1
SCHEMBL25844224	0.94	TYMS (0.38)	TYMSPDK2ALDH1A1TSHRMAPK1
SCHEMBL25861712	0.93	ALDH1A1 (0.37)	TYMSPDK2ALDH1A1TSHRMAPK1
SCHEMBL25844309	0.93	ALDH1A1 (0.37)	TYMSPDK2ALDH1A1TSHRMAPK1
SCHEMBL25861716	0.91	TYMS (0.38)	TYMSPDK2ALDH1A1TSHRMAPK1
SCHEMBL25844411	0.91	TYMS (0.40)	TYMSPDK2ALDH1A1TSHRMAPK1
SCHEMBL25846444	0.90	TYMS (0.35)	TYMSPDK2
SCHEMBL25844415	0.90	TYMS (0.37)	TYMSPDK2ALDH1A1TSHRMAPK1
SCHEMBL25844221	0.90	TYMS (0.37)	TYMSALDH1A1TSHRMAPK1HSD17B10
SCHEMBL25870179	0.89	TYMS (0.38)	TYMSPDK2ALDH1A1TSHRMAPK1

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-2023120714-A1	COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE	出光興産株式会社	2023-06-29	—	—	WO	disclosed