SCHEMBL31497339

CC(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)[C@@H](C)O)[C@@H](C)O

nearest known ligand 0.57

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	BACE1	P56817	6/20	0.57

▸	BACE2	Q9Y5Z0	4/20	0.57

▸	KISS1R	Q969F8	8/20	0.53

▸	TFPI	P10646	1/20	0.51

▸	ERBB2	P04626	1/20	0.49

▸	PTPN1	P18031	1/20	0.48

▸	OPRD1	P41143	1/20	0.48

▸	CASP1	P29466	1/20	0.48

▸	IL23R	Q5VWK5	1/20	0.47

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
SCHEMBL31497332	0.94	BACE1 (0.55)	BACE1BACE2KISS1RTFPIERBB2
SCHEMBL31497394	0.92	BACE1 (0.58)	BACE1BACE2TFPIERBB2
SCHEMBL31497390	0.90	BACE1 (0.60)	BACE1BACE2KISS1RTFPIERBB2
SCHEMBL31497343	0.90	BACE1 (0.60)	BACE1BACE2ERBB2
SCHEMBL31497324	0.88	ERBB2 (0.48)	BACE1BACE2ERBB2PTPN1
SCHEMBL31497356	0.86	BACE1 (0.65)	BACE1BACE2KISS1RTFPI
SCHEMBL31497379	0.86	ERBB2 (0.48)	BACE1BACE2ERBB2PTPN1
SCHEMBL31497319	0.86	SIRT2 (0.47)	BACE1BACE2ERBB2PTPN1
SCHEMBL31497337	0.85	ERBB2 (0.50)	BACE1BACE2ERBB2PTPN1
SCHEMBL31497334	0.84	ERBB2 (0.49)	BACE1BACE2ERBB2PTPN1

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-4545551-A1	PEPTIDE INHIBITOR AND USE THEREOF	Chengdu Brilliant Inspiration Biotherapeutics Co., Ltd (CN)	2025-04-30	—	—	EP	disclosed