SCHEMBL25320179

SCHEMBL25320179

CC(C)(C)OC(=O)N[C@@H](CCOC(F)F)CCC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.44
CTSK P43235 8/20 0.38
CTSS P25774 4/20 0.38
PLA2G2C Q5R387 2/20 0.38
ATM Q13315 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL25320182 1.00 APLNR (0.44) APLNRCTSKCTSSPLA2G2CATM
SCHEMBL5691699 0.87 CA1 (0.46) CTSKCTSSPLA2G2CATMCA1
SCHEMBL31030113 0.84 APLNR (0.48) APLNRCTSKCTSSATMCA1
SCHEMBL28467147 0.84 CA1 (0.40) CTSKCTSSPLA2G2CATMCA1
SCHEMBL28467148 0.84 CA1 (0.40) CTSKCTSSPLA2G2CATMCA1
SCHEMBL25323353 0.83 APLNR (0.44) APLNRCTSKCTSSCA1CA2
SCHEMBL25323351 0.83 APLNR (0.44) APLNRCTSKCTSSCA1CA2
SCHEMBL31030138 0.83 APLNR (0.47) APLNRCTSKCTSSATMCA1
SCHEMBL19337973 0.82 CTSK (0.40) CTSKCTSSPLA2G2CATMCA1
SCHEMBL25319084 0.81 CA1 (0.41) CTSKCTSSPLA2G2CATMCA1

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 7 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
EP-4469448-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. (US) 2024-12-04 EP disclosed
CN-118591537-A PARP7 inhibitors 吉利德科学公司 2024-09-03 CN 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
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 APLNR 3634/4885CTSK 2511/4885CTSS 3101/4885
US-20230365529-A1 PARP7 INHIBITORS PARP1, PARP11, PARP2 APLNR 3634/4885CTSK 2511/4885CTSS 3101/4885

“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.