SCHEMBL25320847

SCHEMBL25320847

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nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA7 P43166 2/20 0.47
CTSK P43235 13/20 0.46
CYP2D6 P10635 1/20 0.43
MEN1 O00255 1/20 0.42
GAA P10253 1/20 0.42
KMT2A Q03164 1/20 0.42
CTSS P25774 4/20 0.41
CA4 P22748 1/20 0.39
CA9 Q16790 1/20 0.39
CTSL P07711 1/20 0.39
CTSB P07858 1/20 0.39

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
SCHEMBL25320849 1.00 CA1 (0.47) CA1CA2CA7CTSKCYP2D6
SCHEMBL4382302 0.95 CA1 (0.46) CA1CA2CA7CTSKCYP2D6
SCHEMBL10431195 0.93 CA1 (0.45) CA1CA2CA7CTSKCYP2D6
SCHEMBL86310 0.89 CA1 (0.50) CA1CA2CA7CTSKCYP2D6
SCHEMBL1654201 0.89 CA1 (0.50) CA1CA2CA7CTSKCYP2D6
SCHEMBL86237 0.89 CA1 (0.50) CA1CA2CA7CTSKCYP2D6
SCHEMBL30803584 0.86 CA1 (0.42) CA1CA2CA7CTSKCYP2D6
SCHEMBL4917594 0.85 CA1 (0.41) CA1CA2CA7CTSKCYP2D6
SCHEMBL24687980 0.84 TDP1 (0.50) CA1CA2CA7CTSKCYP2D6
SCHEMBL12734600 0.84 CTSK (0.61) CTSKCTSS

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 5 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
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 CA1 4498/4885CA2 3900/4885CA7 193/4885
US-20230365529-A1 PARP7 INHIBITORS PARP1, PARP11, PARP2 CA1 4498/4885CA2 3900/4885CA7 193/4885

“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.