SCHEMBL25836754

SCHEMBL25836754

CC(C)(C)OC(=O)NCc1cn(CC(N)=O)cn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.44
CA2 P00918 5/20 0.44
CA9 Q16790 5/20 0.44
CA12 O43570 4/20 0.44
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
CA4 P22748 1/20 0.37
CA7 P43166 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
GRM2 Q14416 1/20 0.36
KDM4A O75164 1/20 0.36
GFER P55789 1/20 0.36
CPB2 Q96IY4 1/20 0.34
NAMPT P43490 1/20 0.34
ALDH1A1 P00352 1/20 0.34
SIRT2 Q8IXJ6 1/20 0.34
SIRT1 Q96EB6 1/20 0.34
SIRT3 Q9NTG7 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
SCHEMBL25836736 0.88 CA1 (0.42) CA1CA2CA9CA12KDM4E
SCHEMBL25836690 0.80 KDM4E (0.46) CA1CA2CA9CA12KDM4E
SCHEMBL25836755 0.75 KMT2A (0.38) CA1CA2CA9LMNAL3MBTL1
SCHEMBL25394615 0.74 AAK1 (0.32) CA1CA2CA9CA12CA7
SCHEMBL30057190 0.74 CA1 (0.42) CA1CA2CA9CA12L3MBTL1
SCHEMBL21503621 0.74 CA1 (0.42) CA1CA2CA9CA12L3MBTL1
SCHEMBL23357725 0.73 CTSS (0.37) CPB2
SCHEMBL28861530 0.73 CPB2 (0.45) CA1CA2CA9CA12LMNA
SCHEMBL1568982 0.73 CPB2 (0.41) CA1CA2CA9CA12GFER
SCHEMBL21071078 0.72 CA1 (0.46) CA1CA2CA9CA12MAOA

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-20230287009-A1 OXO-SUBSTITUTED COMPOUND Sumitomo Pharma Co., Ltd. (JP) 2023-09-14 US disclosed
US-11702431-B2 Oxo-substituted compound Sumitomo Pharma Co., Ltd. (JP) 2023-07-18 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 (2 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-11702431-B2 Oxo-substituted compound CYP51A1, OXA1L, O60361 CA1 3379/4885CA2 2029/4885CA9 422/4885
US-20230287009-A1 OXO-SUBSTITUTED COMPOUND CYP51A1, OXA1L, O60361 CA1 3379/4885CA2 2029/4885CA9 422/4885

“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.