SCHEMBL25061724

SCHEMBL25061724

CCOC(=O)C(C)OCC1(C(=O)OCC)CC(c2cc(NC(=O)Oc3ccccc3)c(F)cc2Cl)=NO1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 7/20 0.33
▸ F2 P00734 5/20 0.33
▸ PRSS1 P07477 4/20 0.33
▸ ITGB1 P05556 1/20 0.32
▸ ITGA4 P13612 1/20 0.32
▸ UBE2M P61081 1/20 0.32
▸ DCUN1D1 Q96GG9 1/20 0.32
▸ CHRM3 P20309 2/20 0.31
▸ FAAH O00519 1/20 0.31
▸ TRPV1 Q8NER1 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ PTGS2 P35354 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ PPOX P50336 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
SCHEMBL25061770 0.96 F10 (0.33) F10F2PRSS1ITGB1ITGA4
SCHEMBL25061768 0.86 — —
SCHEMBL23644650 0.84 CA1 (0.41) F10ITGB1ITGA4FAAHTRPV1
SCHEMBL25061607 0.81 PPOX (0.35) F10F2PPOX
SCHEMBL25061606 0.78 MAPT (0.35) NPSR1PPOX
SCHEMBL25061725 0.77 PPOX (0.33) F10F2PPOX
SCHEMBL25061729 0.76 MAPT (0.34) F10F2PRSS1ITGB1ITGA4
SCHEMBL25061617 0.75 MAPT (0.33) F10F2PRSS1ITGB1ITGA4
SCHEMBL25061769 0.75 PPOX (0.37) PPOX
SCHEMBL25368380 0.73 CA1 (0.39) F10ITGB1ITGA4NPC1RAB9A

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 2779/4885F2 1404/4885PRSS1 4621/4885

“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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