SCHEMBL17978571

SCHEMBL17978571

CCCCc1cn(-c2ccc(N)cc2F)nn1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GABRA2 P47869 4/20 0.46
▸ GABRB2 P47870 4/20 0.46
▸ MIF P14174 1/20 0.45
▸ DDX3X O00571 6/20 0.43
▸ NOTUM Q6P988 2/20 0.42
▸ KCNH2 Q12809 2/20 0.40
▸ P2RX7 Q99572 2/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ RXRA P19793 1/20 0.37
▸ GRIN1 Q05586 1/20 0.37
▸ GRIN2B Q13224 1/20 0.37

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
SCHEMBL17978588 0.79 ALDH1A1 (0.43) GABRA2GABRB2MIFDDX3XNOTUM
SCHEMBL17978544 0.77 MIF (0.67) GABRA2GABRB2MIFDDX3XNOTUM
SCHEMBL4020226 0.76 LRRK2 (0.46) NOTUMRXRAGRIN1GRIN2B
SCHEMBL13939916 0.72 ALDH1A1 (0.36) NOTUMRXRAGRIN1GRIN2B
SCHEMBL28309985 0.70 MIF (0.49) GABRA2GABRB2MIFDDX3XNOTUM
SCHEMBL19232418 0.69 NOTUM (0.52) NOTUML3MBTL1RXRAGRIN1GRIN2B
SCHEMBL12395785 0.67 JAK2 (0.43) GABRA2GABRB2MIFNOTUMKCNH2
SCHEMBL17978520 0.67 DDX3X (0.52) MIFDDX3XKCNH2
SCHEMBL17978602 0.66 MIF (0.51) MIFNOTUM
SCHEMBL21974268 0.66 RXRA (0.59) MIFDDX3XRXRAGRIN1GRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3256461-B1 UREA AND SULFONAMIDE DERIVATIVES AS HUMAN HELICASE DDX3 INHIBITORS USEFUL IN THE TREATMENT OF VIRAL DISEASES AZIENDA OSPEDALIERA UNIV SENESE (IT) 2023-09-13 — — EP disclosed
EP-3432881-B1 USE OF DDX3 INHIBITORS AS ANTIPROLIFERATIVE AGENTS AZIENDA OSPEDALIERA UNIV SENESE (IT) 2021-11-24 — — EP disclosed
US-11000512-B2 Use of DDX3 inhibitors as antiproliferative agents AZIENDA OSPEDALIERA UNIVERSITARIA SENESE (IT) 2021-05-11 — — US disclosed
US-10941121-B2 Human helicase DDX3 inhibitors as therapeutic agents AZIENDA OSPEDALIERA UNIVERSITARIA SENESE (IT) 2021-03-09 — — US disclosed
US-20200140398-A1 HUMAN HELICASE DDX3 INHIBITORS AS THERAPEUTIC AGENTS AZIENDA OSPEDALIERA UNIVERSITARIA SENESE (IT) 2020-05-07 — — US disclosed
US-20190099403-A1 USE OF DDX3 INHIBITORS AS ANTIPROLIFERATIVE AGENTS AZIENDA OSPEDALIERA UNIVERSITARIA SENRESE (IT) 2019-04-04 — — US disclosed
EP-3432881-A1 USE OF DDX3 INHIBITORS AS ANTIPROLIFERATIVE AGENTS Azienda Ospedaliera Universitaria Senese (IT) 2019-01-30 — — EP disclosed
CN-109069484-A Purposes of the DDX3 inhibitor as antiproliferative 锡耶纳大学医院 2018-12-21 — — CN disclosed
US-20180016243-A1 HUMAN HELICASE DDX3 INHIBITORS AS THERAPEUTIC AGENTS AZIENDA OSPEDALIERA UNIVERSITARIA SENESE (IT) 2018-01-18 — — US disclosed
EP-3256461-A1 HUMAN HELICASE DDX3 INHIBITORS AS THERAPEUTIC AGENTS Azienda Ospedaliera Universitaria Senese (IT) 2017-12-20 — — EP disclosed
WO-2017162834-A1 USE OF DDX3 INHIBITORS AS ANTIPROLIFERATIVE AGENTS AZIENDA OSPEDALIERA UNIVERSITARIA SENESE (IT) 2017-09-28 — — WO disclosed
WO-2016128541-A1 HUMAN HELICASE DDX3 INHIBITORS AS THERAPEUTIC AGENTS AZIENDA OSPEDALIERA UNIVERSITARIA SENESE (IT) 2016-08-18 — — WO disclosed
WO-2016128541-A1 HUMAN HELICASE DDX3 INHIBITORS AS THERAPEUTIC AGENTS AZIENDA OSPEDALIERA UNIVERSITARIA SENESE (IT) 2016-08-18 — — 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 (5 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-11000512-B2 Use of DDX3 inhibitors as antiproliferative agents DDX3X, DDX21, DDB1 GABRA2 4270/4885GABRB2 3281/4885MIF 678/4885
US-20180016243-A1 HUMAN HELICASE DDX3 INHIBITORS AS THERAPEUTIC AGENTS DDX3X, DDX39B, DDX1 GABRA2 4414/4885GABRB2 3895/4885MIF 943/4885
US-20200140398-A1 HUMAN HELICASE DDX3 INHIBITORS AS THERAPEUTIC AGENTS DDX3X, DDX39B, DDX1 GABRA2 4414/4885GABRB2 3895/4885MIF 943/4885
US-10941121-B2 Human helicase DDX3 inhibitors as therapeutic agents DDX3X, DDX39B, DDX1 GABRA2 4414/4885GABRB2 3895/4885MIF 943/4885
US-20190099403-A1 USE OF DDX3 INHIBITORS AS ANTIPROLIFERATIVE AGENTS DDX21, DDX3X, DDB1 GABRA2 4302/4885GABRB2 3252/4885MIF 617/4885

“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.

Send feedback