SCHEMBL22158686

SCHEMBL22158686

COc1ccc(Nc2ncc3scc(-c4ccc(N)c([N+](=O)[O-])c4)c3n2)cc1OC.COc1ccc(Nc2ncc3scc(-c4cccnc4OC)c3n2)cc1OC

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 18/20 0.50
JAK2 O60674 1/20 0.42
BRD4 O60885 1/20 0.42
KDR P35968 1/20 0.41

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
SCHEMBL1674160 0.92 PTK2 (0.51) PTK2JAK2BRD4
SCHEMBL29522986 0.92 PTK2 (0.51) PTK2JAK2BRD4
SCHEMBL1674290 0.85 PTK2 (0.61) PTK2KDR
SCHEMBL14853188 0.79 PTK2 (0.55) PTK2JAK2BRD4
SCHEMBL17461677 0.77 PTK2 (0.55) PTK2JAK2BRD4
SCHEMBL17461682 0.76 PTK2 (0.53) PTK2JAK2BRD4
SCHEMBL1674333 0.76 PTK2 (0.60) PTK2JAK2BRD4
SCHEMBL29523379 0.76 PTK2 (0.60) PTK2JAK2BRD4
SCHEMBL1674084 0.75 PTK2 (0.67) PTK2JAK2BRD4
SCHEMBL1674300 0.73 PTK2 (0.62) PTK2JAK2BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11744831-B2 Antiviral JAK inhibitors useful in treating or preventing retroviral and other viral infections EMORY UNIVERSITY (US) 2023-09-05 US claimed
US-11065254-B2 Antiviral JAK inhibitors useful in treating or preventing retroviral and other viral infections THE UNITED STATES GOVERNMENT AS REPRESENTED BY THE DEPARTMENT OF VETERANS AFFAIRS (US) 2021-07-20 US claimed
US-20200206229-A1 ANTIVIRAL JAK INHIBITORS USEFUL IN TREATING OR PREVENTING RETROVIRAL AND OTHER VIRAL INFECTIONS UNIV EMORY (US) 2020-07-02 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-11744831-B2 Antiviral JAK inhibitors useful in treating or preventing retroviral and other viral infections JAK1, JAK3, PNP PTK2 2303/4885JAK2 4/4885BRD4 758/4885
US-20200206229-A1 ANTIVIRAL JAK INHIBITORS USEFUL IN TREATING OR PREVENTING RETROVIRAL AND OTHER VIRAL INFECTIONS JAK1, JAK3, PNP PTK2 1835/4885JAK2 4/4885BRD4 585/4885
US-11065254-B2 Antiviral JAK inhibitors useful in treating or preventing retroviral and other viral infections JAK1, JAK3, PNP PTK2 1835/4885JAK2 4/4885BRD4 585/4885

“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.