SCHEMBL30288239

SCHEMBL30288239

Cn1cc(NCC2CC2)c(C#N)n1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 3/20 0.39
IRAK4 Q9NWZ3 9/20 0.38
ALOX5AP P20292 4/20 0.36
FEN1 P39748 3/20 0.36
ALOX5 P09917 2/20 0.36
BCL6 P41182 1/20 0.36
CYP2C9 P11712 1/20 0.35
BRD4 O60885 1/20 0.34

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
SCHEMBL30288293 0.78 USP30 (0.44) USP30IRAK4BRD4
SCHEMBL22133036 0.73 IRAK4 (0.34) IRAK4ALOX5APFEN1ALOX5CYP2C9
SCHEMBL30288294 0.73 IRAK4 (0.41) IRAK4ALOX5AP
SCHEMBL20662094 0.69 IRAK4 (0.35) IRAK4ALOX5APFEN1ALOX5CYP2C9
SCHEMBL23519500 0.68 CHRM4 (0.39) USP30IRAK4CYP2C9BRD4
SCHEMBL15730719 0.67 ALK (0.33) IRAK4ALOX5APFEN1ALOX5CYP2C9
SCHEMBL28866429 0.66 CHUK (0.46) USP30
SCHEMBL18418875 0.66 ALK (0.39) IRAK4
SCHEMBL23388963 0.66 UTS2R (0.43) BCL6
SCHEMBL23863553 0.65 ALOX5AP (0.58) IRAK4ALOX5APFEN1ALOX5CYP2C9

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-20230055237-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS FLATLEY DISCOVERY LAB, LLC 2023-02-23 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-20230055237-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS CFTR, MPST, CRAT USP30 3326/4885IRAK4 1706/4885ALOX5AP 2118/4885

“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.