SCHEMBL16286121

SCHEMBL16286121

CC(C)C[C@H](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)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(N)=O

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ IL23R Q5VWK5 19/20 0.68
▸ GRPR P30550 1/20 0.64

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
SCHEMBL19492277 0.97 IL23R (0.66) IL23RGRPR
SCHEMBL16263007 0.96 IL23R (0.63) IL23RGRPR
SCHEMBL26713961 0.91 IL23R (0.58) IL23RGRPR
SCHEMBL7156278 0.88 IL23R (0.63) IL23RGRPR
SCHEMBL31433169 0.87 IL23R (0.66) IL23R
SCHEMBL24945842 0.86 IL23R (0.60) IL23RGRPR
SCHEMBL30883264 0.86 IL23R (0.67) IL23R
SCHEMBL31275967 0.86 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-20140363375-A1 ACTIVATION OF BIOLUMINESCENCE BY STRUCTURAL COMPLEMENTATION PROMEGA CORPORATION (US) 2014-12-11 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140363375-A1 ACTIVATION OF BIOLUMINESCENCE BY STRUCTURAL COMPLEMENTATION GLB1, MRPL21, LRBA IL23R 3253/4885GRPR 1083/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

Send feedback