SCHEMBL23642887

SCHEMBL23642887

CCN/C(=N/C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.38
CTSK P43235 6/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
CA1 P00915 5/20 0.35
CA7 P43166 2/20 0.35
CA12 O43570 2/20 0.35
CA14 Q9ULX7 1/20 0.35
CTSS P25774 5/20 0.35
CAPN1 P07384 1/20 0.35
CA2 P00918 4/20 0.34
ALDH1A1 P00352 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
CA9 Q16790 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
SCHEMBL10243061 1.00 TDP1 (0.38) TDP1CTSKKMT2AMEN1GAA
SCHEMBL24780887 0.89 ALDH1A1 (0.34) TDP1CTSKKMT2AMEN1GAA
SCHEMBL3144118 0.87 TDP1 (0.35) TDP1KMT2AMEN1GAACA1
SCHEMBL24669226 0.87 TDP1 (0.39) TDP1CTSKKMT2AMEN1GAA
SCHEMBL15343533 0.87 TDP1 (0.39) TDP1CTSKKMT2AMEN1GAA
SCHEMBL14598292 0.85 TDP1 (0.37) TDP1CTSKKMT2AMEN1GAA
SCHEMBL24669269 0.84 TDP1 (0.44) TDP1CTSKKMT2AMEN1GAA
SCHEMBL20713800 0.84 TDP1 (0.44) TDP1CTSKKMT2AMEN1GAA
SCHEMBL12292244 0.83 TDP1 (0.36) TDP1CTSKKMT2AMEN1GAA
SCHEMBL9339358 0.83 MEN1 (0.37) TDP1CTSKKMT2AMEN1GAA

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
WO-2022192162-A1 NOVEL HETEROAROMATIC COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) 2022-09-15 WO disclosed
US-20210214356-A1 COMPOUNDS AND MEDICAMENTS USING SAME IRIMAJIRI THERAPEUTICS INC. (JP) 2021-07-15 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-20210214356-A1 COMPOUNDS AND MEDICAMENTS USING SAME F12, GDI2, RDX TDP1 3152/4885CTSK 2186/4885KMT2A 1615/4885

“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.