SCHEMBL30239308

CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NS(=O)(=O)N(CCCCCCOCCOCCNC(=O)c1ccc(C(=O)O)c(-c2c3ccc(=O)cc-3oc3cc(O)ccc23)c1)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@@H]2OC(C)(C)O[C@@H]21

nearest known ligand 0.41

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	HTRA2	O43464	8/20	0.41

▸	HTRA1	Q92743	8/20	0.41

▸	FOLH1	Q04609	1/20	0.35

▸	ALB	P02768	1/20	0.34

▸	DOT1L	Q8TEK3	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
SCHEMBL30238904	0.85	DOT1L (0.44)	HTRA2HTRA1DOT1L
SCHEMBL30239335	0.82	DOT1L (0.50)	DOT1L
SCHEMBL31533321	0.81	FOLH1 (0.42)	FOLH1DOT1L
SCHEMBL30239003	0.81	RXFP1 (0.43)	DOT1L
SCHEMBL30238998	0.79	EPRS1 (0.44)	FOLH1DOT1L
SCHEMBL31001630	0.79	CA12 (0.43)	—
SCHEMBL31533318	0.77	DOT1L (0.48)	DOT1L
SCHEMBL30239294	0.73	RXFP1 (0.43)	DOT1L
SCHEMBL31533319	0.73	RXFP1 (0.43)	DOT1L
SCHEMBL31001577	0.72	CA12 (0.43)	—

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
EP-4374157-A2	FRET-BASED ASSAYS	The General Hospital Corporation (US)	2024-05-29	—	—	EP	disclosed
WO-2023004438-A2	FRET-BASED ASSAYS	THE GENERAL HOSPITAL CORPORATION (US)	2023-01-26	—	—	WO	disclosed