SCHEMBL27088011

SCHEMBL27088011

CC(C)(O)Cn1cc(I)c2c(N(C(=O)O)C(=O)OC(C)(C)C)ncnc21

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 1/20 0.33
▸ DYRK3 O43781 1/20 0.31
▸ ROCK2 O75116 1/20 0.31
▸ PRKD3 O94806 1/20 0.31
▸ MAP4K4 O95819 1/20 0.31
▸ PHKG2 P15735 1/20 0.31
▸ PRKACA P17612 1/20 0.31
▸ RPS6KB1 P23443 1/20 0.31
▸ MARK3 P27448 1/20 0.31
▸ FLT3 P36888 1/20 0.31
▸ CSNK1A1 P48729 1/20 0.31
▸ CSNK1D P48730 1/20 0.31
▸ CLK2 P49760 1/20 0.31
▸ IRAK1 P51617 1/20 0.31
▸ CSNK1G2 P78368 1/20 0.31
▸ MAP4K2 Q12851 1/20 0.31
▸ ROCK1 Q13464 1/20 0.31
▸ CAMK2G Q13555 1/20 0.31
▸ CAMK2D Q13557 1/20 0.31
▸ DYRK1A Q13627 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
SCHEMBL29998193 0.95 RET (0.34) RETDYRK3ROCK2PRKD3MAP4K4
SCHEMBL27217811 0.89 — —
SCHEMBL27217996 0.86 FLT3 (0.34) FLT3MKNK2
SCHEMBL27217958 0.84 VCP (0.31) VCP
SCHEMBL30813590 0.83 PDPK1 (0.32) DYRK3ROCK2PRKD3MAP4K4PHKG2
SCHEMBL27088108 0.81 USP30 (0.37) RET
SCHEMBL30813659 0.80 PDPK1 (0.33) DYRK3ROCK2PRKD3MAP4K4PHKG2
SCHEMBL30813359 0.80 FLT3 (0.36) DYRK3ROCK2PRKD3MAP4K4PHKG2
SCHEMBL27218030 0.80 PDPK1 (0.33) DYRK3ROCK2PRKD3MAP4K4PHKG2
SCHEMBL27217948 0.79 SRC (0.39) —

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20240158394-A1 NEK7 INHIBITORS NEK7, NEK5, NEK1 RET 2117/4885DYRK3 1271/4885ROCK2 1375/4885

“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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