SCHEMBL25061478

SCHEMBL25061478

CCOC(=O)CC1(C(=O)OCC)CC(C(C)C)=NO1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 1/20 0.36
▸ ATM Q13315 1/20 0.34
▸ KMT2A Q03164 2/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ GAA P10253 2/20 0.33
▸ LMNA P02545 3/20 0.32
▸ ABCB11 O95342 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ NLRP3 Q96P20 2/20 0.31
▸ CA12 O43570 2/20 0.31
▸ CA9 Q16790 2/20 0.31
▸ TSHR P16473 1/20 0.30
▸ MGAM O43451 1/20 0.30
▸ SI P14410 1/20 0.30
▸ MGAM2 Q2M2H8 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ CA1 P00915 1/20 0.30

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
SCHEMBL25061467 0.87 ATM (0.36) ATMKMT2ALMNAABCB11MAPT
SCHEMBL25061424 0.86 ATM (0.32) ATMKMT2ALMNAMEN1RAB9A
SCHEMBL25061746 0.85 ATM (0.35) ATMLMNAABCB11MAPTMAPK1
SCHEMBL25061518 0.85 ATM (0.35) ATMLMNAABCB11MAPTMAPK1
SCHEMBL25061449 0.85 ATM (0.35) ATMLMNAABCB11MAPTMAPK1
SCHEMBL25061437 0.85 ATM (0.35) ATMLMNAABCB11MAPTMAPK1
SCHEMBL25061645 0.84 ATM (0.34) ATMLMNAABCB11MAPTMAPK1
SCHEMBL25061767 0.83 F10 (0.38) F10ATMKMT2AL3MBTL1GAA
SCHEMBL25061496 0.83 ABCB11 (0.36) ATMLMNAABCB11MAPTMAPK1
SCHEMBL25061766 0.82 F10 (0.37) F10ATMKMT2AL3MBTL1GAA

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-20230053699-A1 SUBSTITUTED-ISOXAZOLINE-CONTAINING AROMATIC COMPOUND, PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF QINGDAO KINGAGROOT CHEMICAL COMPOUND CO., LTD. (CN) 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-20230053699-A1 SUBSTITUTED-ISOXAZOLINE-CONTAINING AROMATIC COMPOUND, PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF CYP4X1, CYP4F11, CBR3 F10 2779/4885ATM 4299/4885KMT2A 2284/4885

“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.

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