SCHEMBL18391413

SCHEMBL18391413

C/C=C(\C)[C@@H](O)[C@H](C)C(=O)N1C(=O)OCC1C(C)C

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
IL6ST P40189 5/20 0.68
STAT3 P40763 1/20 0.59
PIK3CD O00329 1/20 0.39
IDH1 O75874 5/20 0.30

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
SCHEMBL18384326 1.00 IL6ST (0.68) IL6STSTAT3PIK3CDIDH1
SCHEMBL18391412 1.00 IL6ST (0.68) IL6STSTAT3PIK3CDIDH1
SCHEMBL18384293 1.00 IL6ST (0.68) IL6STSTAT3PIK3CDIDH1
SCHEMBL21153766 0.78 IL6ST (0.67) IL6STSTAT3PIK3CDIDH1
SCHEMBL21154125 0.78 IL6ST (0.67) IL6STSTAT3PIK3CDIDH1
SCHEMBL3768819 0.76 IL6ST (0.56) IL6STSTAT3PIK3CDIDH1
SCHEMBL7531951 0.76 IL6ST (0.56) IL6STSTAT3PIK3CDIDH1
SCHEMBL15448141 0.76 IL6ST (0.50) IL6STSTAT3PIK3CDIDH1
SCHEMBL18562134 0.76 IL6ST (0.50) IL6STSTAT3PIK3CDIDH1
SCHEMBL15448064 0.76 IL6ST (0.50) IL6STSTAT3PIK3CDIDH1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10472395-B2 Cyclic peptide analogs and conjugates thereof SIRENAS LLC (US) 2019-11-12 US disclosed
US-20170015710-A1 CYCLIC PEPTIDE ANALOGS AND CONJUGATES THEREOF SIRENAS LLC (US) 2017-01-19 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 (2 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-20170015710-A1 CYCLIC PEPTIDE ANALOGS AND CONJUGATES THEREOF VIP, NGLY1, GRPR IL6ST 1287/4885STAT3 2624/4885PIK3CD 2476/4885
US-10472395-B2 Cyclic peptide analogs and conjugates thereof VIP, NGLY1, GRPR IL6ST 1287/4885STAT3 2624/4885PIK3CD 2476/4885

“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.