SCHEMBL29610995

CC1=C[C@@H]2[C@H]([C@@H](O)C[C@@]3(C)[C@H]2C[C@@H](C)[C@]3(O)C(=O)CO)[C@@]2(C)Cc3cnn(-c4ccccc4)c3C=C12

nearest known ligand 0.85

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	KDM4E	B2RXH2	1/20	0.85

▸	MEN1	O00255	1/20	0.85

▸	KMT2A	Q03164	1/20	0.85

▸	NPSR1	Q6W5P4	1/20	0.85

▸	NR3C1	P04150	19/20	0.55

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
SCHEMBL2078992	0.93	KDM4E (0.90)	KDM4EMEN1KMT2ANPSR1NR3C1
SCHEMBL10311797	0.91	KDM4E (0.87)	KDM4EMEN1KMT2ANPSR1NR3C1
Cortivazol SCHEMBL4875	0.91	KDM4E (0.82)	KDM4EMEN1KMT2ANPSR1NR3C1
Cortivazol SCHEMBL21340660	0.91	KDM4E (0.82)	KDM4EMEN1KMT2ANPSR1NR3C1
Cortivazol SCHEMBL10455984	0.90	KDM4E (0.81)	KDM4EMEN1KMT2ANPSR1NR3C1
Cortivazol SCHEMBL6820239	0.90	KDM4E (0.81)	KDM4EMEN1KMT2ANPSR1NR3C1
SCHEMBL17273905	0.86	KDM4E (0.79)	KDM4EMEN1KMT2ANPSR1NR3C1
Cortivazol SCHEMBL4969166	0.86	KDM4E (0.74)	KDM4EMEN1KMT2ANPSR1NR3C1
SCHEMBL1816131	0.86	KDM4E (0.71)	KDM4EMEN1KMT2ANPSR1NR3C1
SCHEMBL22946293	0.84	KDM4E (0.71)	KDM4EMEN1KMT2ANPSR1NR3C1

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
US-11338120-B2	Methods and devices for treating parasympathetic bias mediated conditions	Palo Alto Investors LP (US)	2022-05-24	—	—	US	disclosed