SCHEMBL30358048

SCHEMBL30358048

C[C@@H](O)[C@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)O)[C@@H](C)O

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ IL23R Q5VWK5 18/20 0.58
▸ TFPI P10646 1/20 0.56
▸ KEAP1 Q14145 1/20 0.54

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
SCHEMBL31031515 0.90 TFPI (0.63) IL23RTFPI
SCHEMBL31031535 0.90 TFPI (0.63) IL23RTFPIKEAP1
SCHEMBL30414074 0.89 TFPI (0.60) IL23RTFPIKEAP1
SCHEMBL29770069 0.89 TFPI (0.63) IL23RTFPIKEAP1
SCHEMBL30385132 0.88 TFPI (0.63) IL23RTFPIKEAP1
SCHEMBL29836412 0.87 TFPI (0.57) IL23RTFPI
SCHEMBL31031575 0.87 TFPI (0.64) IL23RTFPIKEAP1
SCHEMBL30973957 0.87 TFPI (0.64) IL23RTFPIKEAP1
SCHEMBL22807671 0.87 TFPI (0.64) IL23RTFPIKEAP1
SCHEMBL31504570 0.87 TFPI (0.67) IL23RTFPIKEAP1

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-115873118-A Polypeptide designed based on human Dll4 antibody and application thereof 中国药科大学 2023-03-31 — — CN disclosed
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