SCHEMBL29939679

C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)CN)C(=O)NCC(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 7)

	gene	UniProt	supporting neighbours	confidence
▸	APC	P25054	3/20	0.55

▸	QRFPR	Q96P65	2/20	0.49

▸	OPRD1	P41143	6/20	0.49

▸	OPRM1	P35372	5/20	0.49

▸	OPRK1	P41145	2/20	0.49

▸	KEAP1	Q14145	1/20	0.49

▸	BACE1	P56817	5/20	0.49

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
SCHEMBL29512270	1.00	APC (0.55)	APCQRFPROPRD1OPRM1OPRK1
SCHEMBL29664477	0.94	NAALAD2 (0.53)	APCQRFPROPRD1OPRM1KEAP1
SCHEMBL31256956	0.88	OPRD1 (0.57)	APCOPRD1OPRM1OPRK1BACE1
SCHEMBL29904036	0.88	TFPI (0.51)	APCQRFPROPRD1OPRM1OPRK1
SCHEMBL29904057	0.87	OPRD1 (0.66)	APCOPRD1OPRM1OPRK1
SCHEMBL29914576	0.87	TFPI (0.50)	APCQRFPROPRD1OPRM1OPRK1
SCHEMBL29904037	0.86	OPRD1 (0.56)	QRFPROPRD1OPRM1OPRK1
SCHEMBL31257069	0.83	OPRD1 (0.57)	OPRD1OPRM1OPRK1BACE1
SCHEMBL30440289	0.83	OPRD1 (0.56)	APCOPRD1OPRM1OPRK1
SCHEMBL29896984	0.82	MME (0.52)	QRFPROPRD1OPRM1OPRK1

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
CN-116867506-A	Pharmaceutical compositions comprising friedreich ataxin fusion proteins and methods of use thereof	拉利玛生物医药公司	2023-10-10	—	—	CN	disclosed
WO-2022155432-A1	MATERIALS AND METHODS FOR QUANTIFYING PRECURSOR TAMM-HORSFALL PROTEIN	THE TRUSTEES OF INDIANA UNIVERSITY (US)	2022-07-21	—	—	WO	disclosed