SCHEMBL26413544

SCHEMBL26413544

CN(C(=O)OC(C)(C)C)N(S(=O)(=O)c1ccccc1)S(=O)(=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 2/20 0.45
▸ CCR5 P51681 2/20 0.43
▸ KMT2A Q03164 1/20 0.41
▸ F2 P00734 1/20 0.41
▸ MMP13 P45452 1/20 0.40
▸ ESR2 Q92731 1/20 0.40
▸ NR1H3 Q13133 1/20 0.40
▸ MAPT P10636 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ NR1I2 O75469 1/20 0.38

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
SCHEMBL26413555 0.86 AGER (0.45) KMT2AF2MAPTSMN1; SMN2ALDH1A1
SCHEMBL28034923 0.84 HSD11B1 (0.56) HSD11B1CCR5KMT2AF2MMP13
SCHEMBL26413513 0.80 HSD11B1 (0.44) HSD11B1CCR5KMT2AF2MMP13
SCHEMBL26413565 0.77 F2 (0.43) HSD11B1CCR5KMT2AF2MMP13
SCHEMBL28610867 0.76 ESR1 (0.46) HSD11B1CCR5KMT2AF2MMP13
SCHEMBL7815449 0.75 PTGES (0.43) HSD11B1CCR5KMT2AESR2NR1H3
SCHEMBL11514144 0.74 F2 (0.41) HSD11B1CCR5KMT2AF2MMP13
SCHEMBL1511696 0.72 F2 (0.37) HSD11B1CCR5KMT2AF2MMP13
SCHEMBL3836513 0.72 CCR5 (0.41) HSD11B1CCR5KMT2AF2ESR2
SCHEMBL26413534 0.71 CTSD (0.33) —

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-20230127728-A1 MODIFIED GRAPHENE, METHOD OF PRODUCING MODIFIED GRAPHENE, MODIFIED GRAPHENE-RESIN COMPOSITE, MODIFIED GRAPHENE SHEET, AND MODIFIED GRAPHENE DISPERSION CANON KK (JP) 2023-04-27 — — 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-20230127728-A1 MODIFIED GRAPHENE, METHOD OF PRODUCING MODIFIED GRAPHENE, MODIFIED GRAPHENE-RESIN COMPOSITE, MODIFIED GRAPHENE SHEET, AND MODIFIED GRAPHENE DISPERSION GRIA1, GRIN1, NR3C1 HSD11B1 403/4885CCR5 1922/4885KMT2A 4267/4885

“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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