SCHEMBL29769340

SCHEMBL29769340

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

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ IL23R Q5VWK5 20/20 0.65

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL30683193 1.00 IL23R (0.65) IL23R
SCHEMBL30607169 1.00 IL23R (0.65) IL23R
SCHEMBL29769339 0.98 IL23R (0.65) IL23R
SCHEMBL29769338 0.93 IL23R (0.58) IL23R
SCHEMBL31683260 0.89 GLP1R (0.64) IL23R
SCHEMBL29479855 0.89 GLP1R (0.69) IL23R
SCHEMBL22968949 0.89 IL23R (0.67) IL23R
SCHEMBL30918362 0.88 IL23R (0.69) IL23R
SCHEMBL29540171 0.87 IL23R (0.64) IL23R
SCHEMBL30906573 0.87 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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114478797-A Hydrolysis targeting chimera of targeting DDX24 protein and application thereof 中山大学附属第五医院 2022-05-13 — — CN disclosed
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