SCHEMBL30574249

CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)CN)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)[C@@H](C)O)C(C)C)C(C)C

nearest known ligand 0.71

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	NPY2R	P49146	10/20	0.71

▸	NPY1R	P25929	10/20	0.71

▸	NPY4R	P50391	8/20	0.71

▸	NPY5R	Q15761	8/20	0.71

▸	TFPI	P10646	4/20	0.66

▸	RAMP3	O60896	3/20	0.62

▸	CALCR	P30988	3/20	0.62

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
SCHEMBL29356625	1.00	NPY2R (0.71)	NPY2RNPY1RNPY4RNPY5RTFPI
SCHEMBL30574250	0.97	NPY2R (0.72)	NPY2RNPY1RNPY4RNPY5RTFPI
SCHEMBL30574247	0.95	NPY2R (0.74)	NPY2RNPY1RNPY4RNPY5RTFPI
SCHEMBL29360416	0.94	NPY2R (0.66)	NPY2RNPY1RNPY4RNPY5RTFPI
SCHEMBL4331434	0.90	NPY2R (0.75)	NPY2RNPY1RNPY4RNPY5RTFPI
SCHEMBL29359777	0.89	NPY2R (0.63)	NPY2RNPY1RNPY4RNPY5RTFPI
SCHEMBL15669203	0.88	NPY2R (0.74)	NPY2RNPY1RNPY4RNPY5RTFPI
SCHEMBL15669269	0.88	NPY2R (0.76)	NPY2RNPY1RNPY4RNPY5RTFPI
SCHEMBL9979655	0.88	NPY2R (0.69)	NPY2RNPY1RNPY4RNPY5RTFPI
SCHEMBL238214	0.87	NPY2R (0.69)	NPY2RNPY1RNPY4RNPY5RTFPI

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
US-12180485-B2	Repressible control of gene expression	TRUSTEES OF BOSTON UNIVERSITY (US)	2024-12-31	—	—	US	disclosed
US-20230279406-A1	INDUCIBLE CONTROL OF GENE EXPRESSION	TRUSTEES OF BOSTON UNIVERSITY (US)	2023-09-07	—	—	US	disclosed