SCHEMBL25321350

SCHEMBL25321350

CC(C)(C)OC(=O)N[C@H](CCCn1ccc2cc(B3OC(C)(C)C(C)(C)O3)c(F)cc2c1=O)C1CC1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TIPARP Q7Z3E1 2/20 0.32
▸ PRMT5 O14744 1/20 0.32
▸ WDR77 Q9BQA1 1/20 0.32
▸ TNF P01375 7/20 0.32
▸ PSMB1 P20618 1/20 0.31
▸ PSMB5 P28074 1/20 0.31
▸ AAK1 Q2M2I8 2/20 0.31
▸ SCN9A Q15858 3/20 0.30
▸ HDAC3 O15379 1/20 0.30
▸ HDAC1 Q13547 1/20 0.30
▸ HDAC6 Q9UBN7 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
SCHEMBL30550612 1.00 TIPARP (0.32) TIPARPPRMT5WDR77TNFPSMB1
SCHEMBL25321355 1.00 TIPARP (0.32) TIPARPPRMT5WDR77TNFPSMB1
SCHEMBL25321508 0.88 TNF (0.34) TIPARPTNFPSMB1PSMB5HDAC3
SCHEMBL25321504 0.88 TNF (0.34) TIPARPTNFPSMB1PSMB5HDAC3
SCHEMBL25318208 0.84 AAK1 (0.36) TIPARPTNFPSMB1PSMB5AAK1
SCHEMBL25318213 0.84 AAK1 (0.36) TIPARPTNFPSMB1PSMB5AAK1
SCHEMBL30550660 0.82 TNF (0.38) TIPARPPRMT5WDR77TNFPSMB1
SCHEMBL30550681 0.82 PRMT5 (0.34) PRMT5WDR77TNFAAK1HDAC3
SCHEMBL25898854 0.82 PRMT5 (0.34) PRMT5WDR77TNFAAK1HDAC3
SCHEMBL25898500 0.81 TIPARP (0.34) TIPARPTNFHDAC3HDAC1HDAC6

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 491/4885PRMT5 1133/4885WDR77 527/4885
US-20230365529-A1 PARP7 INHIBITORS PARP1, PARP11, PARP2 TIPARP 491/4885PRMT5 1133/4885WDR77 527/4885

“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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