SCHEMBL31277220

SCHEMBL31277220

C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)CN)C(=O)N[C@@H](CS)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ IL23R Q5VWK5 6/20 0.45
▸ OPRL1 P41146 2/20 0.42
▸ TFPI P10646 1/20 0.42
▸ CXCR4 P61073 2/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.40
▸ NPBWR1 P48145 1/20 0.40
▸ NPY5R Q15761 3/20 0.40
▸ NPY1R P25929 2/20 0.40
▸ NPY4R P50391 2/20 0.40

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
SCHEMBL30186416 0.94 IL23R (0.44) IL23ROPRL1TFPICXCR4NPY5R
SCHEMBL31737509 0.91 IL23R (0.45) IL23ROPRL1CXCR4
SCHEMBL30186434 0.89 IL23R (0.44) IL23ROPRL1TFPICXCR4RXFP1
SCHEMBL29595677 0.88 TFPI (0.38) IL23RTFPI
SCHEMBL29533613 0.88 NPY4R (0.47) NPY5RNPY1RNPY4R
SCHEMBL29414583 0.86 IL23R (0.45) IL23ROPRL1TFPIRXFP1
SCHEMBL30186406 0.86 NPY4R (0.40) IL23ROPRL1CXCR4NPY5RNPY1R
SCHEMBL7861254 0.86 NPY4R (0.47) NPY5RNPY1RNPY4R
SCHEMBL7861255 0.86 NPY4R (0.47) NPY5RNPY1RNPY4R
SCHEMBL31689761 0.85 IL23R (0.42) IL23ROPRL1NPY5RNPY1RNPY4R

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
WO-2024211447-A1 TP508 MRNAS CHRYSALIS BIOTHERAPEUTICS (US) 2024-10-10 — — WO disclosed
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