SCHEMBL21216245

CCCC[C@H](NC(C)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)O)C(C)(C)C)[C@@H](C)O

nearest known ligand 0.61

Predicted protein targets (top 1)

	gene	UniProt	supporting neighbours	confidence
▸	IL23R	Q5VWK5	20/20	0.61

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
SCHEMBL30658135	0.98	IL23R (0.61)	IL23R
SCHEMBL22969142	0.98	IL23R (0.61)	IL23R
SCHEMBL22969036	0.98	IL23R (0.61)	IL23R
SCHEMBL26622772	0.95	IL23R (0.59)	IL23R
SCHEMBL26622850	0.95	IL23R (0.59)	IL23R
SCHEMBL22969246	0.95	IL23R (0.66)	IL23R
SCHEMBL30658140	0.95	IL23R (0.66)	IL23R
SCHEMBL30658136	0.92	IL23R (0.67)	IL23R
SCHEMBL30658146	0.92	IL23R (0.68)	IL23R
SCHEMBL22969247	0.92	IL23R (0.68)	IL23R

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-2019148195-A2	CYCLIC PEPTIDYL INHIBITORS OF CAL-PDZ BINDING DOMAIN	OHIO STATE INNOVATION FOUNDATION (US)	2019-08-01	—	—	WO	disclosed