SCHEMBL31388959

SCHEMBL31388959

CC(C)(C)OC(=O)NC(COC(F)F)CC(F)Cn1ccc2cc(Br)c(F)cc2c1=O

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ AAK1 Q2M2I8 6/20 0.41
▸ TIPARP Q7Z3E1 2/20 0.34
▸ PSMB1 P20618 4/20 0.33
▸ PSMB5 P28074 4/20 0.33
▸ APLNR P35414 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
SCHEMBL31388966 0.91 AAK1 (0.39) AAK1PSMB1PSMB5
SCHEMBL25318426 0.82 AAK1 (0.40) AAK1PSMB1PSMB5
SCHEMBL31058394 0.82 AAK1 (0.40) AAK1PSMB1PSMB5
SCHEMBL25318429 0.82 AAK1 (0.40) AAK1PSMB1PSMB5
SCHEMBL25320533 0.81 TIPARP (0.40) AAK1TIPARPPSMB1PSMB5
SCHEMBL25320536 0.81 TIPARP (0.40) AAK1TIPARPPSMB1PSMB5
SCHEMBL31362889 0.79 AAK1 (0.37) AAK1PSMB1PSMB5
SCHEMBL25322149 0.77 AAK1 (0.38) AAK1TIPARPPSMB1PSMB5
SCHEMBL25322154 0.77 AAK1 (0.38) AAK1TIPARPPSMB1PSMB5
SCHEMBL25319637 0.76 PSMB1 (0.40) AAK1PSMB1PSMB5

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-20250066328-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. 2025-02-27 — — 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-20250066328-A1 PARP7 INHIBITORS PARP1, PARP2, PARP8 AAK1 2461/4885TIPARP 524/4885PSMB1 1697/4885

“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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