SCHEMBL30948003

SCHEMBL30948003

O=c1c(=O)n(C2CC3CC3C2)ccn1Cc1ccc(Cl)nn1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IL4I1 Q96RQ9 6/20 0.40
MAPT P10636 2/20 0.31
THRB P10828 1/20 0.31
VEGFA P15692 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31
TP53 P04637 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL30947915 0.86 IL4I1 (0.51) IL4I1MAPTTHRBVEGFAEGLN1
SCHEMBL30948185 0.86 IL4I1 (0.54) IL4I1MAPTTHRBVEGFAEGLN1
SCHEMBL30948249 0.81 IL4I1 (0.49) IL4I1
SCHEMBL30948217 0.79 IL4I1 (0.37) IL4I1
SCHEMBL30045512 0.79 IL4I1 (0.38) IL4I1
SCHEMBL30947934 0.78 IL4I1 (0.55) IL4I1THRB
SCHEMBL30948359 0.77 IL4I1 (0.39) IL4I1
SCHEMBL30948279 0.73 IL4I1 (0.37) IL4I1
SCHEMBL30948167 0.72 IL4I1 (0.50) IL4I1MAPTTHRBVEGFAEGLN1
SCHEMBL30948286 0.72 IL4I1 (0.50) IL4I1

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-20240246937-A1 IL4I1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2024-07-25 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-20240246937-A1 IL4I1 INHIBITORS AND METHODS OF USE IL4I1, IL4, IL2 IL4I1 1/4885MAPT 3067/4885THRB 1350/4885

“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.