SCHEMBL29415091

SCHEMBL29415091

C[C@@H](O)[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCN)C(=O)N[C@@H](CO)C(=O)N[C@H](CCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCN)C(=O)N[C@@H](CCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O)C(C)(C)S

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ IL23R Q5VWK5 10/20 0.48
▸ NPY4R P50391 9/20 0.46
▸ NPY1R P25929 6/20 0.46
▸ NPY2R P49146 4/20 0.46
▸ NPY5R Q15761 4/20 0.46
▸ TFPI P10646 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL29415116 1.00 IL23R (0.48) IL23RNPY4RNPY1RNPY2RNPY5R
SCHEMBL29415075 0.99 IL23R (0.47) IL23RNPY4RNPY1RNPY2RNPY5R
SCHEMBL29415160 0.97 IL23R (0.52) IL23RTFPI
SCHEMBL29415147 0.97 IL23R (0.52) IL23RTFPI
SCHEMBL29415118 0.97 IL23R (0.52) IL23RTFPI
SCHEMBL29415133 0.97 IL23R (0.52) IL23RTFPI
SCHEMBL29415148 0.95 IL23R (0.49) IL23RTFPI
SCHEMBL29415131 0.94 IL23R (0.53) IL23R
SCHEMBL29415110 0.94 IL23R (0.53) IL23R
SCHEMBL29415154 0.94 IL23R (0.53) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4214220-A1 ANTIMICROBIAL PEPTIDOMIMETICS Spexis AG (CH) 2023-07-26 — — EP claimed
WO-2022028737-A1 ANTIMICROBIAL PEPTIDOMIMETICS POLYPHOR AG (CH) 2022-02-10 — — WO claimed
EP-4214220-A1 ANTIMICROBIAL PEPTIDOMIMETICS Spexis AG (CH) 2023-07-26 — — EP disclosed
WO-2022028737-A1 ANTIMICROBIAL PEPTIDOMIMETICS POLYPHOR AG (CH) 2022-02-10 — — WO disclosed
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