SCHEMBL30853589

SCHEMBL30853589

COc1ncccc1C(=O)Nc1cccc(-c2nncn2[C@@H](C)C(F)(F)F)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAP3K5 Q99683 20/20 1.00

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
SCHEMBL23244551 1.00 MAP3K5 (1.00) MAP3K5
SCHEMBL23244552 1.00 MAP3K5 (1.00) MAP3K5
SCHEMBL23244561 1.00 MAP3K5 (1.00) MAP3K5
SCHEMBL23244553 0.90 MAP3K5 (0.82) MAP3K5
SCHEMBL23244564 0.89 MAP3K5 (0.79) MAP3K5
SCHEMBL23244548 0.89 MAP3K5 (0.79) MAP3K5
SCHEMBL23244545 0.89 MAP3K5 (0.79) MAP3K5
SCHEMBL23244601 0.88 MAP3K5 (0.79) MAP3K5
SCHEMBL23244602 0.88 MAP3K5 (0.79) MAP3K5
SCHEMBL23244558 0.88 MAP3K5 (1.00) MAP3K5

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-20240109867-A1 ASK1 INHIBITING AGENTS BIOGEN MA INC. 2024-04-04 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-20240109867-A1 ASK1 INHIBITING AGENTS MAP3K1, MAP3K10, MAP3K20 MAP3K5 12/4885

“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.