SCHEMBL29678075

CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)O)[C@@H](C)O

nearest known ligand 0.47

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	MAPK8	P45983	1/20	0.47

▸	MAPK9	P45984	1/20	0.47

▸	MAPK10	P53779	1/20	0.47

▸	NTSR2	O95665	13/20	0.47

▸	NTSR1	P30989	13/20	0.47

▸	SORT1	Q99523	11/20	0.47

▸	CALCRL	Q16602	1/20	0.46

▸	CAPN1	P07384	2/20	0.46

▸	REN	P00797	1/20	0.45

▸	XIAP	P98170	1/20	0.44

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
SCHEMBL29678167	0.95	CAPN1 (0.48)	MAPK8MAPK9MAPK10NTSR2NTSR1
SCHEMBL29976151	0.87	CALCRL (0.44)	NTSR2NTSR1SORT1CALCRLCAPN1
SCHEMBL29590984	0.84	NTSR2 (0.49)	NTSR2NTSR1SORT1CAPN1REN
SCHEMBL29678210	0.84	NPY1R (0.58)	NTSR2NTSR1SORT1CALCRL
SCHEMBL31026618	0.83	NTSR1 (0.49)	MAPK8MAPK9MAPK10NTSR2NTSR1
SCHEMBL29625336	0.83	XIAP (0.53)	NTSR2NTSR1SORT1RENXIAP
SCHEMBL31688339	0.83	CAPN1 (0.51)	NTSR2NTSR1SORT1CALCRLCAPN1
SCHEMBL30512527	0.82	RAMP3 (0.51)	MAPK8MAPK9MAPK10
SCHEMBL30988889	0.82	CALCRL (0.49)	CALCRLCAPN1REN
SCHEMBL31257014	0.81	XIAP (0.54)	MAPK8MAPK9MAPK10NTSR2NTSR1

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-4003403-A1	RECEPTOR-TARGETING PEPTIDE-DRUG CONJUGATES	Molgenie GmbH (DE)	2022-06-01	—	—	EP	claimed