SCHEMBL29403130

CC(C)[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N(C)[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)[C@@H](C)O

nearest known ligand 0.65

Predicted protein targets (top 3)

	gene	UniProt	supporting neighbours	confidence
▸	IL23R	Q5VWK5	13/20	0.65

▸	KISS1R	Q969F8	6/20	0.58

▸	CD47	Q08722	1/20	0.55

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
SCHEMBL29403216	0.96	IL23R (0.66)	IL23RKISS1R
SCHEMBL12417333	0.95	IL23R (0.66)	IL23RKISS1RCD47
SCHEMBL13248747	0.95	IL23R (0.66)	IL23RKISS1RCD47
SCHEMBL12508010	0.95	IL23R (0.66)	IL23RKISS1RCD47
SCHEMBL13248737	0.94	IL23R (0.66)	IL23RKISS1RCD47
SCHEMBL29400465	0.93	KISS1R (0.69)	IL23RKISS1R
SCHEMBL13367313	0.93	KISS1R (0.64)	IL23RKISS1R
SCHEMBL13460202	0.93	KISS1R (0.64)	IL23RKISS1R
SCHEMBL14520566	0.93	KISS1R (0.64)	IL23RKISS1R
SCHEMBL29400672	0.93	KISS1R (0.64)	IL23RKISS1R

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
US-11273223-B2	Bispecific anti-hapten/anti-blood brain barrier receptor antibodies, complexes thereof and their use as blood brain barrier shuttles	HOFFMANN-LA ROCHE INC. (US)	2022-03-15	—	—	US	disclosed