SCHEMBL29333345

SCHEMBL29333345

Cc1nc(C(C)C)ncc1N

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
UHRF1 Q96T88 1/20 0.35
TKT P29401 1/20 0.35
APLNR P35414 2/20 0.33
POLB P06746 1/20 0.33
NOS3 P29474 1/20 0.32
NOS1 P29475 1/20 0.32
NOS2 P35228 1/20 0.32

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
SCHEMBL1785253 0.80 POLB (0.40) UHRF1TKTAPLNRPOLB
SCHEMBL17297734 0.78 POLB (0.33) UHRF1TKTPOLB
SCHEMBL12447891 0.77 APLNR (0.35) TKTAPLNRNOS3NOS1NOS2
SCHEMBL2737354 0.77 APLNR (0.35) TKTAPLNR
SCHEMBL10996190 0.77 TKT (0.35) UHRF1TKTAPLNRPOLB
SCHEMBL5800504 0.77 POLB (0.33) UHRF1TKTPOLB
SCHEMBL5779559 0.77 POLB (0.33) UHRF1TKTPOLB
SCHEMBL14998951 0.74 PTGS1 (0.35) TKTAPLNRPOLB
SCHEMBL21374860 0.74 APLNR (0.33) TKTAPLNR
SCHEMBL25928371 0.74 APLNR (0.33) TKTAPLNR

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 1 patent. 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

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 UHRF1 302/4885TKT 2526/4885APLNR 3369/4885

“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.