SCHEMBL9105244

CC(C)(CC(=O)N[C@@H]1CCc2cc(C(F)(F)F)ccc2N(Cc2ccc(-c3ccccc3S(=O)(=O)NC(=O)c3ccccc3)cc2)C1=O)NC[C@H](O)CO

nearest known ligand 0.52

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	AGTR1	P30556	4/20	0.44

▸	GHSR	Q92847	1/20	0.44

▸	PTGER1	P34995	9/20	0.43

▸	PTGER3	P43115	9/20	0.43

▸	PTGER4	P35408	8/20	0.43

▸	PTGER2	P43116	5/20	0.43

▸	TBXA2R	P21731	4/20	0.43

▸	PTGFR	P43088	4/20	0.43

▸	PTGIR	P43119	4/20	0.43

▸	PTGDR	Q13258	4/20	0.43

▸	AGTR2	P50052	2/20	0.40

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
SCHEMBL9103755	0.94	AGTR1 (0.45)	AGTR1GHSRPTGER1PTGER3PTGER4
SCHEMBL9102870	0.93	AGTR1 (0.45)	AGTR1GHSRPTGER1PTGER3PTGER4
SCHEMBL9103754	0.92	GHSR (0.44)	AGTR1GHSRPTGER1PTGER3PTGER4
SCHEMBL9105733	0.92	GHSR (0.52)	AGTR1GHSRPTGER1PTGER3PTGER4
SCHEMBL9106037	0.92	AGTR1 (0.44)	AGTR1GHSRPTGER1PTGER3PTGER4
SCHEMBL9106243	0.92	GHSR (0.44)	AGTR1GHSRPTGER1PTGER3PTGER4
SCHEMBL9104946	0.91	AGTR1 (0.44)	AGTR1GHSRPTGER1PTGER3PTGER4
SCHEMBL9109380	0.91	GHSR (0.47)	AGTR1GHSRPTGER1PTGER3PTGER4
SCHEMBL9108750	0.89	GHSR (0.56)	AGTR1GHSRPTGER1PTGER3PTGER4
SCHEMBL9108223	0.88	AGTR1 (0.45)	AGTR1GHSRPTGER1PTGER3PTGER4

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-5434261-A	Benzo-fused lactams promote release of growth hormone	MERCK & CO., INC. (US)	1995-07-18	—	—	US	disclosed