SCHEMBL25321176

SCHEMBL25321176

CC(C)(C)OC(=O)N[C@H](CCCn1ccc2cc(-c3ncc(C(F)(F)F)cn3)c(F)cc2c1=O)C1CC1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TIPARP Q7Z3E1 6/20 0.45
▸ CCRL2 O00421 2/20 0.33
▸ ACACB O00763 2/20 0.33
▸ FLT3 P36888 3/20 0.32
▸ KIT P10721 1/20 0.32
▸ HCRTR1 O43613 3/20 0.32
▸ CHEK1 O14757 2/20 0.31
▸ ALOX5AP P20292 1/20 0.31
▸ FEN1 P39748 1/20 0.31
▸ TNF P01375 1/20 0.31
▸ CCR2 P41597 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
SCHEMBL30550856 1.00 TIPARP (0.45) TIPARPCCRL2ACACBFLT3KIT
SCHEMBL25321183 1.00 TIPARP (0.45) TIPARPCCRL2ACACBFLT3KIT
SCHEMBL30550827 0.87 TIPARP (0.49) TIPARPCCRL2ALOX5APFEN1TNF
SCHEMBL25321393 0.87 TIPARP (0.46) TIPARP
SCHEMBL30550616 0.87 TIPARP (0.46) TIPARP
SCHEMBL25321386 0.87 TIPARP (0.46) TIPARP
SCHEMBL25319273 0.87 TIPARP (0.49) TIPARPCCRL2ALOX5APFEN1TNF
SCHEMBL25319270 0.87 TIPARP (0.49) TIPARPCCRL2ALOX5APFEN1TNF
SCHEMBL30550717 0.87 TIPARP (0.46) TIPARPTNF
SCHEMBL26782305 0.87 TIPARP (0.46) TIPARPTNF

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 4 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
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 491/4885CCRL2 3705/4885ACACB 3869/4885
US-20230365529-A1 PARP7 INHIBITORS PARP1, PARP11, PARP2 TIPARP 491/4885CCRL2 3705/4885ACACB 3869/4885

“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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