SCHEMBL25836737

SCHEMBL25836737

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

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.39
KMT2A Q03164 3/20 0.38
TSHR P16473 2/20 0.38
HSD17B10 Q99714 1/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37
MEN1 O00255 2/20 0.36
ALDH1A1 P00352 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 1/20 0.36
ATM Q13315 1/20 0.36
FPR2 P25090 3/20 0.36
TRPA1 O75762 1/20 0.36
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34
CTSK P43235 1/20 0.34
MAPK1 P28482 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
SCHEMBL25836755 0.89 KMT2A (0.38) CYP2D6KMT2ATSHRHSD17B10CA1
SCHEMBL23038453 0.85 CTSS (0.38) CYP2D6KMT2ACA1CA2CA7
SCHEMBL30455998 0.84 CTSS (0.35) CYP2D6KMT2ACA1CA2CA7
SCHEMBL25836705 0.78 DGAT2 (0.44) KMT2ATSHRHSD17B10CA1CA2
SCHEMBL23357725 0.75 CTSS (0.37) KMT2AMEN1ATMTRPA1CTSK
SCHEMBL25836736 0.74 CA1 (0.42) CA1CA2CA7ALDH1A1L3MBTL1
SCHEMBL25397406 0.74 KDM4E (0.34) CYP2D6CA1CA7ALDH1A1ATM
SCHEMBL28503393 0.74 CTSK (0.34) HSD17B10CA1CA2CA7ATM
SCHEMBL3586455 0.74 ALPL (0.47) KMT2AALDH1A1L3MBTL1KDM4E
SCHEMBL3122071 0.73 ALPL (0.46) KMT2AALDH1A1L3MBTL1FPR2KDM4E

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 CYP2D6 241/4885KMT2A 2610/4885TSHR 4401/4885
US-20230287009-A1 OXO-SUBSTITUTED COMPOUND CYP51A1, OXA1L, O60361 CYP2D6 241/4885KMT2A 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.