SCHEMBL24438815

SCHEMBL24438815

CC(=O)Nc1ccc(NC(=O)c2cc(Cl)ccc2O)cc1

nearest known ligand 0.82

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ P2RX1 P51575 10/20 0.82
▸ TMPRSS4 Q9NRS4 9/20 0.72
▸ P2RX4 Q99571 5/20 0.69
▸ P2RX7 Q99572 5/20 0.69
▸ KCNMA1 Q12791 3/20 0.68
▸ ALDH1A1 P00352 1/20 0.68
▸ SMN1; SMN2 Q16637 1/20 0.62
▸ MEN1 O00255 1/20 0.59
▸ IKBKB O14920 1/20 0.59
▸ CHUK O15111 1/20 0.59
▸ KDR P35968 1/20 0.59
▸ FLT3 P36888 1/20 0.59
▸ KMT2A Q03164 1/20 0.59
▸ MYLK Q15746 1/20 0.59
▸ MAP4K5 Q9Y4K4 1/20 0.59

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
SCHEMBL29454776 0.90 P2RX1 (1.00) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL2169619 0.90 P2RX1 (1.00) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL18341044 0.88 P2RX1 (0.77) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL13812666 0.88 P2RX1 (0.82) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL23685650 0.88 P2RX1 (0.82) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL30692659 0.87 P2RX1 (0.87) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL24438716 0.87 P2RX1 (0.87) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL15889827 0.86 P2RX1 (0.61) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL23675471 0.84 P2RX1 (0.82) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL17845883 0.84 P2RX1 (0.82) P2RX1TMPRSS4P2RX4P2RX7KCNMA1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022109148-A1 SMALL MOLECULE INHIBITORS OF SARS-COV-2 INFECTIONS THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES (US) 2022-05-27 — — WO claimed
US-20240002332-A1 Small Molecule Inhibitors of SARS-CoV-2 Infections THE FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION 2024-01-04 — — US disclosed
US-20230406831-A1 COMPOUNDS AND METHODS OF INHIBITING BACTERIAL CHAPERONIN SYSTEMS THE TRUSTEES OF INDIANA UNIVERSITY 2023-12-21 — — US disclosed
WO-2022109148-A1 SMALL MOLECULE INHIBITORS OF SARS-COV-2 INFECTIONS THE USA, AS REPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES (US) 2022-05-27 — — WO disclosed
WO-2022103572-A1 COMPOUNDS AND METHODS OF INHIBITING BACTERIAL CHAPERONIN SYSTEMS THE TRUSTEES OF INDIANA UNIVERSITY (US) 2022-05-19 — — WO 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-20240002332-A1 Small Molecule Inhibitors of SARS-CoV-2 Infections ACE2, ACE, TMPRSS2 P2RX1 2669/4885TMPRSS4 14/4885P2RX4 3287/4885
US-20230406831-A1 COMPOUNDS AND METHODS OF INHIBITING BACTERIAL CHAPERONIN SYSTEMS HSP90B1, HSPBP1, HSP90AB1 P2RX1 4633/4885TMPRSS4 3530/4885P2RX4 4679/4885

“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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