SCHEMBL630635

CC1(C)C(=O)N(c2ccc(NS(C)(=O)=O)c(C(F)(F)F)c2)C(=O)N1CCCCCCCCC[S+]([O-])CCCC(F)(F)C(F)(F)F.CN(C)CC(=O)Nc1ccc(N2C(=O)N(CCCCCCCCCSCCCC(F)(F)C(F)(F)F)C(C)(C)C2=O)cc1C(F)(F)F.CN(C)CC(=O)Nc1ccc(N2C(=O)N(CCCCCCCCC[S+]([O-])CCCC(F)(F)C(F)(F)F)C(C)(C)C2=O)cc1C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 3)

	gene	UniProt	supporting neighbours	confidence
▸	AR	P10275	12/20	0.38

▸	PGR	P06401	1/20	0.38

▸	HDAC1	Q13547	4/20	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
SCHEMBL629295	0.91	AR (0.44)	ARPGRHDAC1
Hydrochloric Acid SCHEMBL891225	0.90	AR (0.44)	ARPGRHDAC1
SCHEMBL891215	0.89	AR (0.46)	ARPGRHDAC1
SCHEMBL629446	0.87	AR (0.46)	ARPGRHDAC1
SCHEMBL629084	0.82	AR (0.47)	ARPGRHDAC1
SCHEMBL629373	0.80	AR (0.49)	ARPGRHDAC1
SCHEMBL890874	0.77	AR (0.46)	ARPGR
SCHEMBL890608	0.76	AR (0.47)	ARPGRHDAC1
SCHEMBL628972	0.75	AR (0.50)	ARPGR
SCHEMBL890915	0.74	AR (0.49)	ARPGRHDAC1

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
EP-2419410-A1	IMIDAZOLIDINE-2,4-DIONE DERIVATIVES, AND USE THEREOF AS A CANCER DRUG	IPSEN PHARMA S.A.S. (FR)	2012-02-22	—	—	EP	disclosed