SCHEMBL25319273

SCHEMBL25319273

CC(C)(C)OC(=O)NC(CO)CCCn1ccc2cc(-c3ncc(C(F)(F)F)cn3)c(F)cc2c1=O

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TIPARP Q7Z3E1 6/20 0.49
▸ TNF P01375 5/20 0.32
▸ AAK1 Q2M2I8 2/20 0.32
▸ ALOX5AP P20292 2/20 0.30
▸ FEN1 P39748 2/20 0.30
▸ PLK1 P53350 2/20 0.30
▸ CCRL2 O00421 1/20 0.30
▸ PSMB1 P20618 1/20 0.30
▸ PSMB5 P28074 1/20 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
SCHEMBL30550827 1.00 TIPARP (0.49) TIPARPTNFAAK1ALOX5APFEN1
SCHEMBL25319270 1.00 TIPARP (0.49) TIPARPTNFAAK1ALOX5APFEN1
SCHEMBL25320426 0.93 TIPARP (0.50) TIPARPTNFAAK1PSMB1PSMB5
SCHEMBL30550605 0.93 TIPARP (0.50) TIPARPTNFAAK1PSMB1PSMB5
SCHEMBL25320428 0.93 TIPARP (0.50) TIPARPTNFAAK1PSMB1PSMB5
SCHEMBL30550616 0.89 TIPARP (0.46) TIPARPPLK1
SCHEMBL25321393 0.89 TIPARP (0.46) TIPARPPLK1
SCHEMBL25321386 0.89 TIPARP (0.46) TIPARPPLK1
SCHEMBL30550717 0.89 TIPARP (0.46) TIPARPTNFPLK1PSMB1PSMB5
SCHEMBL26782305 0.89 TIPARP (0.46) TIPARPTNFPLK1PSMB1PSMB5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12459922-B2 PARP7 inhibitors GILEAD SCIENCES, INC. (US) 2025-11-04 — — US disclosed
US-20230365529-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. 2023-11-16 — — US disclosed
WO-2023147418-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. (US) 2023-08-03 — — WO 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-12459922-B2 PARP7 inhibitors PARP1, PARP11, PARP2 TIPARP 491/4885TNF 4831/4885AAK1 2312/4885
US-20230365529-A1 PARP7 INHIBITORS PARP1, PARP11, PARP2 TIPARP 491/4885TNF 4831/4885AAK1 2312/4885

“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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