SCHEMBL19492277

SCHEMBL19492277

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

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ IL23R Q5VWK5 19/20 0.66
▸ GRPR P30550 1/20 0.60

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
SCHEMBL16286121 0.97 IL23R (0.68) IL23RGRPR
SCHEMBL16263007 0.96 IL23R (0.63) IL23RGRPR
SCHEMBL26713961 0.91 IL23R (0.58) IL23RGRPR
SCHEMBL24945842 0.88 IL23R (0.60) IL23RGRPR
SCHEMBL31433169 0.87 IL23R (0.66) IL23R
SCHEMBL7156278 0.87 IL23R (0.63) IL23RGRPR
SCHEMBL30883264 0.85 IL23R (0.67) IL23R
SCHEMBL31275967 0.85 RXFP1 (0.65) IL23RGRPR
SCHEMBL31433168 0.85 IL23R (0.64) IL23R
SCHEMBL30026081 0.85 ERAP2 (0.59) IL23RGRPR

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
US-9797890-B2 Activation of bioluminescence by structural complementation PROMEGA CORPORATION (US) 2017-10-24 — — US disclosed
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