SCHEMBL31672836

CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)CN)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC

nearest known ligand 0.52

Predicted protein targets (top 18)

	gene	UniProt	supporting neighbours	confidence
▸	RXFP1	Q9HBX9	2/20	0.52

▸	MAPK8	P45983	1/20	0.50

▸	MAPK9	P45984	1/20	0.50

▸	MAPK10	P53779	1/20	0.50

▸	TFPI	P10646	1/20	0.48

▸	GRIN2D	O15399	1/20	0.47

▸	GRIN3B	O60391	1/20	0.47

▸	GRIN1	Q05586	1/20	0.47

▸	GRIN2A	Q12879	1/20	0.47

▸	GRIN2B	Q13224	1/20	0.47

▸	GRIN2C	Q14957	1/20	0.47

▸	GRIN3A	Q8TCU5	1/20	0.47

▸	VIPR2	P41587	6/20	0.46

▸	VIPR1	P32241	3/20	0.46

▸	GRPR	P30550	1/20	0.45

▸	HRAS	P01112	1/20	0.44

▸	KRAS	P01116	1/20	0.44

▸	SOS1	Q07889	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
SCHEMBL31182934	0.90	RXFP1 (0.58)	RXFP1TFPIVIPR2VIPR1
SCHEMBL30111306	0.88	RXFP1 (0.50)	RXFP1TFPIGRIN2DGRIN3BGRIN1
SCHEMBL29489382	0.87	GRIN2D (0.59)	RXFP1TFPIGRIN2DGRIN3BGRIN1
SCHEMBL30483686	0.86	VIPR2 (0.48)	RXFP1MAPK8MAPK9MAPK10TFPI
SCHEMBL30395894	0.86	GRIN2D (0.49)	RXFP1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL29470910	0.86	RXFP1 (0.56)	RXFP1TFPIGRIN2DGRIN3BGRIN1
SCHEMBL31084114	0.86	MAPK8 (0.46)	RXFP1MAPK8MAPK9MAPK10GRIN2D
SCHEMBL31084116	0.86	MAPK8 (0.46)	RXFP1MAPK8MAPK9MAPK10GRIN2D
SCHEMBL29677485	0.85	RXFP1 (0.53)	RXFP1TFPIGRIN2DGRIN3BGRIN1
SCHEMBL31084109	0.85	GRIN2D (0.48)	RXFP1GRIN2DGRIN3BGRIN1GRIN2A

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-3400955-B1	USE OF CRYPTONIN FOR TREATMENT OF CANCER	ISTANBUL UNIV REKTORLUGU (TR)	2025-08-13	—	—	EP	disclosed