SCHEMBL17978557

SCHEMBL17978557

Cc1ccc(S(=O)(=O)OCCCc2cn(-c3ccc([N+](=O)[O-])cc3)nn2)cc1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PSMD10 O75832 1/20 0.69
CA12 O43570 4/20 0.47
CA1 P00915 4/20 0.47
CA2 P00918 4/20 0.47
CA9 Q16790 4/20 0.47
CYP19A1 P11511 4/20 0.47
NOTUM Q6P988 1/20 0.43
PTGS2 P35354 2/20 0.43
AMY1A P0DUB6 1/20 0.41
RXRA P19793 2/20 0.41
GRIN1 Q05586 2/20 0.41
GRIN2B Q13224 2/20 0.41
PTGS1 P23219 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
SCHEMBL17978568 0.97 PSMD10 (0.65) PSMD10CA12CA1CA2CA9
SCHEMBL9382983 0.78 ACHE (0.52)
SCHEMBL17978538 0.78 MIF (0.59) CA12CA1CA2CA9PTGS2
SCHEMBL17978469 0.77 DDX3X (0.50) CA12CA1CA2CA9CYP19A1
SCHEMBL17978492 0.76 PTGS2 (0.51) CA12CA1CA2CA9CYP19A1
SCHEMBL17978524 0.76 PTGS2 (0.51) CA12CA1CA2CA9CYP19A1
SCHEMBL9325413 0.75 ACHE (0.51)
SCHEMBL17978573 0.75 DDX3X (0.55) CA12CA1CA2CA9CYP19A1
SCHEMBL17978627 0.75 MIF (0.51) CA12CA1CA2CA9CYP19A1
SCHEMBL17978515 0.75 CA12 (0.52) CA12CA1CA2CA9CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115448908-B Compounds for the treatment of specific leukemias 拓臻股份有限公司 2025-04-25 CN disclosed
CN-115215838-B Compounds for the treatment of specific leukemias 拓臻股份有限公司 2025-04-04 CN disclosed
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-A1 USE OF DDX3 INHIBITORS AS ANTIPROLIFERATIVE AGENTS Azienda Ospedaliera Universitaria Senese (IT) 2019-01-30 EP 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