SCHEMBL27245205

SCHEMBL27245205

CS(=O)(=O)c1ccc2c(c1)O[C@@]1(C[C@@H](C(N)=O)N(C(=O)O)C1)C(=O)N2

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.34
▸ AKR1B1 P15121 1/20 0.33
▸ BRD4 O60885 4/20 0.32
▸ EPHX1 P07099 1/20 0.31
▸ EPHX2 P34913 1/20 0.31
▸ MAPT P10636 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
SCHEMBL30890471 0.87 NR1H2 (0.41) —
SCHEMBL27244814 0.84 L3MBTL1 (0.33) AKR1B1MAPT
SCHEMBL27245173 0.82 OTUD7B (0.36) —
SCHEMBL27244767 0.78 AKR1B1 (0.39) AKR1B1
Hydrochloric Acid SCHEMBL27244995 0.77 TDP1 (0.34) TDP1AKR1B1BRD4
Hydrochloric Acid SCHEMBL30890534 0.77 TDP1 (0.34) TDP1AKR1B1BRD4
SCHEMBL27244758 0.75 OTUD7B (0.38) —
SCHEMBL27244782 0.73 SIRT2 (0.30) —
SCHEMBL27245195 0.73 OTUD7B (0.37) —
SCHEMBL27245098 0.73 CNR2 (0.32) —

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-20240199647-A1 ANTI-VIRAL COMPOUNDS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2024-06-20 — — 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-20240199647-A1 ANTI-VIRAL COMPOUNDS EIF2AK2, ZC3HAV1, HAVCR2 TDP1 2526/4885AKR1B1 3356/4885BRD4 1775/4885

“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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