SCHEMBL24767249

SCHEMBL24767249

CCC[C@H](NC(=O)[C@H](C)NC)C(=O)N1C[C@@H](OC(C)=O)C[C@H]1Cc1c(-c2[nH]c3cc(F)ccc3c2C[C@@H]2C[C@H](OC(C)=O)CN2C(=O)[C@H](CC)NC(=O)[C@H](C)NC)[nH]c2cc(F)ccc12

nearest known ligand 0.76

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BIRC3 Q13489 12/20 0.76
XIAP P98170 11/20 0.76
BIRC2 Q13490 3/20 0.76
BIRC7 Q96CA5 1/20 0.76
TNF P01375 12/20 0.62

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
SCHEMBL12946318 0.97 BIRC3 (0.80) BIRC3XIAPBIRC2BIRC7TNF
SCHEMBL950069 0.97 BIRC3 (0.80) BIRC3XIAPBIRC2BIRC7TNF
SCHEMBL14848175 0.97 BIRC3 (0.80) BIRC3XIAPBIRC2BIRC7TNF
SCHEMBL30416136 0.97 BIRC3 (0.80) BIRC3XIAPBIRC2BIRC7TNF
SCHEMBL5037496 0.97 BIRC3 (0.80) BIRC3XIAPBIRC2BIRC7TNF
SCHEMBL14848206 0.97 BIRC3 (0.80) BIRC3XIAPBIRC2BIRC7TNF
SCHEMBL24767185 0.96 BIRC3 (0.70) BIRC3XIAPBIRC2BIRC7TNF
SCHEMBL25461046 0.94 BIRC3 (0.87) BIRC3XIAPBIRC2BIRC7TNF
SCHEMBL24767336 0.94 BIRC3 (0.75) BIRC3XIAPBIRC2BIRC7TNF
SCHEMBL21260485 0.94 BIRC3 (0.75) BIRC3XIAPBIRC2BIRC7TNF

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-20220396566-A1 LIVER TARGETING DRUG, PHARMACEUTICAL COMPOSITION AND USE THEREOF DU, Jessica Xinyun 2022-12-15 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-20220396566-A1 LIVER TARGETING DRUG, PHARMACEUTICAL COMPOSITION AND USE THEREOF SLC10A1, ABCB11, CYP7A1 BIRC3 4759/4885XIAP 2711/4885BIRC2 4828/4885

“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.