SCHEMBL31135225

CC(C)C[C@H](NC(=O)[C@@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	C5AR1	P21730	2/20	0.64

▸	GNRHR	P30968	1/20	0.63

▸	ABCC2	Q92887	1/20	0.63

▸	PTGS1	P23219	1/20	0.63

▸	APLNR	P35414	4/20	0.60

▸	CXCR4	P61073	3/20	0.59

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
SCHEMBL30839205	0.97	GNRHR (0.64)	C5AR1GNRHRABCC2PTGS1APLNR
SCHEMBL29425251	0.96	GNRHR (0.64)	C5AR1GNRHRABCC2PTGS1APLNR
SCHEMBL30839204	0.96	GNRHR (0.64)	C5AR1GNRHRABCC2PTGS1APLNR
SCHEMBL30198868	0.95	GNRHR (0.66)	C5AR1GNRHRABCC2PTGS1APLNR
SCHEMBL29425250	0.95	GNRHR (0.70)	C5AR1GNRHRABCC2PTGS1APLNR
SCHEMBL30773556	0.94	PTGS1 (0.71)	C5AR1GNRHRABCC2PTGS1APLNR
SCHEMBL6512254	0.94	PTGS1 (0.71)	C5AR1GNRHRABCC2PTGS1APLNR
SCHEMBL29857994	0.93	GNRHR (0.67)	C5AR1GNRHRABCC2PTGS1APLNR
SCHEMBL31733948	0.93	GNRHR (0.67)	C5AR1GNRHRABCC2PTGS1APLNR
Deslorelin SCHEMBL25353366	0.92	GNRHR (0.74)	C5AR1GNRHRABCC2PTGS1APLNR

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
WO-2024210903-A1	MODIFIED PEPTIDE LIGANDS FOR STABLE DELIVERY OF HIGHLY POTENT PAYLOADS TO TUMORS: METHOD OF MAKING AND USING SAME	LAMHARZI NAJIB (US)	2024-10-10	—	—	WO	disclosed