SCHEMBL23958391

SCHEMBL23958391

C=C/C=C\C(=C/C)S(=O)(=O)Nc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 2/20 0.43
▸ CA1 P00915 2/20 0.39
▸ CA2 P00918 2/20 0.39
▸ IL1RN P18510 1/20 0.38
▸ ERAP1 Q9NZ08 1/20 0.38
▸ CA12 O43570 2/20 0.37
▸ CA9 Q16790 2/20 0.37
▸ KMT2A Q03164 4/20 0.36
▸ MEN1 O00255 3/20 0.36
▸ PKM P14618 2/20 0.36
▸ TGM2 P21980 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ HDAC3 O15379 2/20 0.35
▸ HDAC4 P56524 2/20 0.35
▸ HDAC1 Q13547 2/20 0.35
▸ HDAC7 Q8WUI4 2/20 0.35
▸ HDAC2 Q92769 2/20 0.35
▸ HDAC10 Q969S8 2/20 0.35
▸ HDAC11 Q96DB2 2/20 0.35
▸ HDAC8 Q9BY41 2/20 0.35

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
SCHEMBL20623069 0.87 KEAP1 (0.39) KEAP1CA1CA2IL1RNERAP1
SCHEMBL21504863 0.83 SMN1; SMN2 (0.46) CA1CA2KMT2AMEN1ALDH1A1
SCHEMBL24977490 0.83 KEAP1 (0.48) KEAP1CA1CA2IL1RNERAP1
SCHEMBL18466103 0.77 ALDH1A1 (0.44) CA1CA2KMT2AMEN1PKM
SCHEMBL18763270 0.73 — —
SCHEMBL22669673 0.71 ALDH1A1 (0.31) ALDH1A1
SCHEMBL9231787 0.71 KEAP1 (0.56) KEAP1CA1CA2IL1RNERAP1
SCHEMBL23797104 0.71 SMN1; SMN2 (0.43) CA1CA2CA12CA9KMT2A
SCHEMBL25788337 0.71 — —
SCHEMBL22519836 0.70 EPHX2 (0.37) CA1CA2CA12CA9KMT2A

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-11660294-B2 Compounds, compositions, and methods for the treatment and prevention of avian pathogenic E. coli (APEC) OHIO STATE INNOVATION FOUNDATION (US) 2023-05-30 — — US disclosed
US-20210330655-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR THE TREATMENT AND PREVENTION OF AVIAN PATHOGENIC E. COLI (APEC) OHIO STATE INNOVATION FOUNDATION 2021-10-28 — — 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-11660294-B2 Compounds, compositions, and methods for the treatment and prevention of avian pathogenic E. coli (APEC) FABP2, APC, AP1G1 KEAP1 804/4885CA1 1525/4885CA2 2835/4885
US-20210330655-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR THE TREATMENT AND PREVENTION OF AVIAN PATHOGENIC E. COLI (APEC) FABP2, APC, AP1G1 KEAP1 804/4885CA1 1525/4885CA2 2835/4885

“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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