SCHEMBL13209217

SCHEMBL13209217

CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(=O)O)C(=O)NC(C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCCCN)C(N)=O)C(C)O)[C@@H](C)O

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ IL23R Q5VWK5 16/20 0.61
▸ SYK P43405 3/20 0.56
▸ TFPI P10646 1/20 0.56

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
SCHEMBL13254722 0.93 IL23R (0.54) IL23RSYKTFPI
SCHEMBL29531748 0.88 OPRD1 (0.53) IL23R
SCHEMBL25627431 0.87 APC (0.52) IL23RTFPI
SCHEMBL30061253 0.86 F2 (0.54) IL23RTFPI
SCHEMBL29611494 0.86 BACE1 (0.58) IL23RTFPI
SCHEMBL31369291 0.85 KISS1R (0.61) IL23RTFPI
SCHEMBL24324740 0.84 NPY1R (0.55) —
SCHEMBL15317805 0.84 OPRM1 (0.56) IL23RSYK
SCHEMBL29611881 0.84 F2 (0.59) IL23RTFPI
SCHEMBL26873736 0.83 OPRM1 (0.48) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100196282-A1 OPTICAL IMAGING AGENTS GE HEALTHCARE LIMITED (GB) 2010-08-05 — — 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-20100196282-A1 OPTICAL IMAGING AGENTS VIP, SSTR4, NGLY1 IL23R 3090/4885SYK 295/4885TFPI 1977/4885

“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.

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