SCHEMBL25836705

SCHEMBL25836705

CC(NC(=O)OC(C)(C)C)c1cn(C(=O)OC(C)(C)C)cn1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DGAT2 Q96PD7 1/20 0.44
KMT2A Q03164 4/20 0.40
TSHR P16473 2/20 0.40
HSD17B10 Q99714 1/20 0.40
TRPA1 O75762 1/20 0.38
MAPK1 P28482 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
MAPT P10636 2/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
MEN1 O00255 3/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ALDH1A1 P00352 1/20 0.36
ATM Q13315 1/20 0.35
LMNA P02545 1/20 0.34
POLB P06746 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
SCHEMBL8368700 0.84 CTSS (0.38) DGAT2KMT2ATRPA1MAPK1L3MBTL1
SCHEMBL23636217 0.83 DGAT2 (0.35) DGAT2KMT2ATRPA1MAPK1L3MBTL1
SCHEMBL5849380 0.81 DGAT2 (0.37) DGAT2KMT2AMAPK1L3MBTL1MAPT
SCHEMBL16043434 0.80 DGAT2 (0.40) DGAT2ATM
SCHEMBL25836737 0.78 CYP2D6 (0.39) KMT2ATSHRHSD17B10TRPA1MAPK1
SCHEMBL21536759 0.78 DGAT2 (0.36) DGAT2KMT2ATSHRMAPK1L3MBTL1
SCHEMBL25836755 0.77 KMT2A (0.38) KMT2ATSHRHSD17B10TRPA1MAPK1
Oxalic Acid SCHEMBL7028461 0.77 DGAT2 (0.35) DGAT2ATM
SCHEMBL10928236 0.74 DGAT2 (0.34) DGAT2MAPK1L3MBTL1MAPTATM
SCHEMBL13650201 0.74 ITGB3 (0.45) MAPK1

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 DGAT2 1524/4885KMT2A 2610/4885TSHR 4401/4885
US-20230287009-A1 OXO-SUBSTITUTED COMPOUND CYP51A1, OXA1L, O60361 DGAT2 1524/4885KMT2A 2610/4885TSHR 4401/4885

“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.