SCHEMBL29333804

SCHEMBL29333804

C=CC(=O)N1[C@H](c2cc(Cl)cc(-c3ccnc(N)n3)c2)COC[C@H]1C(F)F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 4/20 0.36
DBF4 Q9UBU7 2/20 0.36
JAK2 O60674 3/20 0.34
KMO O15229 2/20 0.32
BTK Q06187 1/20 0.32
CAMKK2 Q96RR4 1/20 0.32
CDK2 P24941 2/20 0.31
ROCK2 O75116 1/20 0.31
MAP4K4 O95819 1/20 0.31
GSK3B P49841 1/20 0.31
CLK4 Q9HAZ1 1/20 0.31
IRAK4 Q9NWZ3 1/20 0.31
KRAS P01116 3/20 0.30
PIM1 P11309 1/20 0.30
CCNT1 O60563 1/20 0.30
CSNK2A2 P19784 1/20 0.30
CCNE1 P24864 1/20 0.30
CSNK1A1 P48729 1/20 0.30
CSNK1D P48730 1/20 0.30
CDK9 P50750 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
SCHEMBL29336222 1.00 CDC7 (0.36) CDC7DBF4JAK2KMOBTK
SCHEMBL30855104 1.00 CDC7 (0.36) CDC7DBF4JAK2KMOBTK
SCHEMBL31008647 0.87 KRAS (0.30) KRAS
SCHEMBL29335948 0.87 KRAS (0.30) KRAS
SCHEMBL29333662 0.87 KRAS (0.30) KRAS
SCHEMBL29333531 0.87 CDC7 (0.38) CDC7DBF4JAK2KMOBTK
SCHEMBL31008631 0.87 CDC7 (0.38) CDC7DBF4JAK2KMOBTK
SCHEMBL29336225 0.82
SCHEMBL29333805 0.82
SCHEMBL30855063 0.82

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240226114-A1 INHIBITORS AND USES THEREOF VIVIDION THERAPEUTICS, INC. 2024-07-11 US disclosed
US-20240226114-A1 INHIBITORS AND USES THEREOF VIVIDION THERAPEUTICS, INC. 2024-07-11 US 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-20240226114-A1 INHIBITORS AND USES THEREOF KEAP1, NQO1, NFE2L2 CDC7 991/4885DBF4 957/4885JAK2 1725/4885

“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.