SCHEMBL29998475

SCHEMBL29998475

CC(C)(O)Cn1cc(B2OC(C)(C)C(C)(C)O2)c2c(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)ncnc21

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 2/20 0.39
▸ FFAR1 O14842 1/20 0.36
▸ BACE1 P56817 1/20 0.33
▸ BACE2 Q9Y5Z0 1/20 0.33
▸ RET P07949 1/20 0.33
▸ AAK1 Q2M2I8 1/20 0.31
▸ PDPK1 O15530 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
SCHEMBL27088108 0.95 USP30 (0.37) USP30FFAR1BACE1BACE2RET
SCHEMBL30813409 0.89 USP30 (0.39) USP30BACE1BACE2AAK1PDPK1
SCHEMBL30813583 0.87 USP30 (0.38) USP30BACE1BACE2AAK1
SCHEMBL27217891 0.87 USP30 (0.38) USP30BACE1BACE2AAK1
SCHEMBL27217794 0.84 USP30 (0.37) USP30BACE1BACE2
SCHEMBL30813487 0.83 USP30 (0.44) USP30BACE1BACE2AAK1PDPK1
SCHEMBL21221307 0.81 USP30 (0.39) USP30BACE1BACE2
SCHEMBL29998193 0.80 RET (0.34) RETPDPK1
SCHEMBL30813509 0.80 USP30 (0.39) USP30BACE1BACE2
SCHEMBL30813573 0.80 USP30 (0.38) USP30BACE1BACE2AAK1

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-20240317758-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. 2024-09-26 — — US disclosed
US-20240158394-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. 2024-05-16 — — US disclosed
WO-2024059200-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. (US) 2024-03-21 — — WO disclosed
EP-4320127-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. (US) 2024-02-14 — — EP disclosed
WO-2022216680-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. (US) 2022-10-13 — — 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-20240317758-A1 NEK7 INHIBITORS NEK7, NEK5, NEK1 USP30 2703/4885FFAR1 1656/4885BACE1 232/4885
US-20240158394-A1 NEK7 INHIBITORS NEK7, NEK5, NEK1 USP30 1845/4885FFAR1 2766/4885BACE1 207/4885

“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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