SCHEMBL25455599

SCHEMBL25455599

CNC(CCCNC(=O)OCc1ccccc1)C(=O)OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.60
▸ FOLH1 Q04609 3/20 0.58
▸ LMNA P02545 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ MMP2 P08253 2/20 0.55
▸ MMP9 P14780 2/20 0.55
▸ TGM2 P21980 1/20 0.54
▸ KEAP1 Q14145 2/20 0.53
▸ NFE2L2 Q16236 2/20 0.53
▸ CA1 P00915 1/20 0.52
▸ CA2 P00918 1/20 0.52
▸ SLC1A3 P43003 1/20 0.51
▸ SLC1A1 P43005 1/20 0.51
▸ CPB1 P15086 1/20 0.51
▸ CPB2 Q96IY4 1/20 0.51

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
SCHEMBL17995299 0.92 FOLH1 (0.64) HTTFOLH1LMNASMN1; SMN2MMP2
SCHEMBL31265519 0.88 FOLH1 (0.69) HTTFOLH1MMP2MMP9TGM2
SCHEMBL31265517 0.88 FOLH1 (0.69) HTTFOLH1MMP2MMP9TGM2
SCHEMBL13227705 0.88 FOLH1 (0.69) HTTFOLH1MMP2MMP9TGM2
SCHEMBL23901494 0.87 HTT (0.58) HTTFOLH1LMNASMN1; SMN2MMP2
SCHEMBL25988051 0.86 FOLH1 (0.60) HTTFOLH1MMP2MMP9TGM2
SCHEMBL22674651 0.86 FOLH1 (0.60) HTTFOLH1MMP2MMP9TGM2
SCHEMBL14719982 0.86 MAPT (0.61) HTTFOLH1MMP2MMP9
SCHEMBL14719981 0.86 MAPT (0.61) HTTFOLH1MMP2MMP9
SCHEMBL16269911 0.85 LMNA (0.57) HTTFOLH1LMNASMN1; SMN2TGM2

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-20230143470-A1 SMALL MOLECULE INHIBITORS OF INFLUENZA HEMAGGLUTININ NATIONAL INSTITUTES OF HEALTH 2023-05-11 — — 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-20230143470-A1 SMALL MOLECULE INHIBITORS OF INFLUENZA HEMAGGLUTININ HAVCR2, CD44, ENGASE HTT 1336/4885FOLH1 2246/4885LMNA 2333/4885

“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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