SCHEMBL413671

SCHEMBL413671

NCCCCCCNS(=O)(=O)c1cccc2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 10/20 1.00
CYP1A2 P05177 7/20 1.00
CYP2C19 P33261 7/20 1.00
CYP2C9 P11712 6/20 1.00
SCN1A P35498 3/20 1.00
SCN2A Q99250 3/20 1.00
SCN3A Q9NY46 3/20 1.00
ALDH1A1 P00352 3/20 1.00
KDM4E B2RXH2 2/20 1.00
HSD17B10 Q99714 2/20 1.00
TP53 P04637 8/20 0.71
MEN1 O00255 7/20 0.71
KMT2A Q03164 7/20 0.71
CYP2D6 P10635 6/20 0.71
THPO P40225 4/20 0.71
MAPK1 P28482 3/20 0.71
TSHR P16473 3/20 0.71
FPR2 P25090 2/20 0.71
TDP1 Q9NUW8 2/20 0.71
MAPT P10636 1/20 0.71

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
SCHEMBL30306219 1.00 CYP3A4 (1.00) CYP3A4CYP1A2CYP2C19CYP2C9SCN1A
SCHEMBL6753337 1.00 CYP3A4 (1.00) CYP3A4CYP1A2CYP2C19CYP2C9SCN1A
Hydrochloric Acid SCHEMBL1844492 0.99 SCN1A (1.00) CYP3A4CYP1A2CYP2C19CYP2C9SCN1A
Hydrochloric Acid SCHEMBL11629031 0.99 SCN1A (1.00) CYP3A4CYP1A2CYP2C19CYP2C9SCN1A
SCHEMBL8024067 0.98 CYP3A4 (0.97) CYP3A4CYP1A2CYP2C19CYP2C9SCN1A
Hydrochloric Acid SCHEMBL15720831 0.97 CYP3A4 (0.94) CYP3A4CYP1A2CYP2C19CYP2C9SCN1A
Hydrochloric Acid SCHEMBL27202576 0.93 SCN1A (0.89) CYP3A4CYP1A2CYP2C19CYP2C9SCN1A
SCHEMBL14516834 0.90 CYP3A4 (0.82) CYP3A4CYP1A2CYP2C19CYP2C9SCN1A
SCHEMBL4263470 0.88 CYP3A4 (0.78) CYP3A4CYP1A2CYP2C19CYP2C9SCN1A
SCHEMBL27975068 0.87 CYP3A4 (0.80) CYP3A4CYP1A2CYP2C19CYP2C9SCN1A

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 60 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2825173-B1 CALMODULIN INHIBITORS FOR THE TREATMENT OF RIBOSOMAL DISORDERS AND RIBOSOMAPATHIES CHILDRENS MEDICAL CENTER (US) 2018-10-10 EP claimed
WO-2010035047-A1 BINARY COMPOSITIONS COMPRISING AN NO-DONOR AND AN A-SMASE INHIBITOR FOR THE TREATMENT OF RESPIRATORY DISEASES PHARMAPATENTS GLOBAL LTD. (GB) 2010-04-01 WO claimed
EP-0305008-A2 Tumor or cancer cell killing therapy and agents useful therefor OXI-GENE, INC. (US) 1989-03-01 EP claimed
US-20240245703-A1 TOPICAL APPLICATION OF AGENTS TO REDUCE SUN SENSITIVITY AND IMPROVE TOPICAL PHOTODYNAMIC THERAPY NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2024-07-25 US disclosed
US-20240130367-A1 PLANT GROWTH PROMOTERS UNIVERSITY OF DURHAM (GB) 2024-04-25 US disclosed
EP-4266883-A1 PLANT GROWTH PROMOTERS University of Durham (GB) 2023-11-01 EP disclosed
CN-116916750-A plant growth promoter 杜伦大学 2023-10-20 CN disclosed
US-11654149-B2 Calmodulin inhibitors for the treatment of ribosomal disorders and ribosomapathies CHILDREN'S MEDICAL CENTER CORPORATION (US) 2023-05-23 US disclosed
US-11654149-B2 Calmodulin inhibitors for the treatment of ribosomal disorders and ribosomapathies CHILDREN'S MEDICAL CENTER CORPORATION (US) 2023-05-23 US disclosed
WO-2023053097-A1 TOPICAL APPLICATION OF AGENTS TO REDUCE SUN SENSITIVITY AND IMPROVE TOPICAL PHOTODYNAMIC THERAPY THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF VETERANS AFFAIRS (US) 2023-04-06 WO disclosed
WO-2022136838-A1 PLANT GROWTH PROMOTERS UNIVERSITY OF DURHAM (GB) 2022-06-30 WO disclosed
WO-1998050065-A2 THE USE OF BIOLOGICALLY ACTIVE SUBSTANCES FOR INFLUENCING THE EXTRACELLULAR AREA OF SENSORY CELLS AND METHOD FOR CONTROLLING THE ADMINISTRATION OF ACTIVE SUBSTANCES AND DEVICE USED THEREIN ECKMILLER MARION SANGSTER (DE) 1998-11-12 WO disclosed
EP-0781335-A1 CLONING AND CHARACTERIZING OF GENES ASSOCIATED WITH LONG-TERM MEMORY COLD SPRING HARBOR LABORATORY (US) 1997-07-02 EP disclosed
EP-0729356-A1 USE OF NITRIC OXIDE SYNTHASE INHIBITORS IN THE TREATMENT OF AUTOIMMUNE DISEASES DUKE UNIVERSITY MEDICAL CENTER (US) 1996-09-04 EP disclosed
WO-1996011270-A9 CLONING AND CHARACTERIZING OF GENES ASSOCIATED WITH LONG-TERM MEMORY 1996-07-11 WO disclosed
WO-1996011270-A1 CLONING AND CHARACTERIZING OF GENES ASSOCIATED WITH LONG-TERM MEMORY COLD SPRING HARBOR LABORATORY (US) 1996-04-18 WO disclosed
WO-1995013805-A1 USE OF NITRIC OXIDE SYNTHASE INHIBITORS IN THE TREATMENT OF AUTOIMMUNE DISEASES DUKE UNIVERSITY MEDICAL CENTER (US) 1995-05-26 WO disclosed
US-5340565-A Administering an n-substituted benzamide to activate adenosine diphosphate ribosyl transferase to cytolysis OXI-GENE, INC. (US) 1994-08-23 US disclosed
US-5104858-A Administering trans-flupenthiyol with doxorubicin; lack of antipsychotic activity reduces side effects YALE UNIVERSITY (US) 1992-04-14 US disclosed
EP-0361485-A2 A method of sensitizing multidrug resistant cells to antitumor agents YALE UNIVERSITY (US) 1990-04-04 EP 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-11654149-B2 Calmodulin inhibitors for the treatment of ribosomal disorders and ribosomapathies CALM1, RACK1, RRBP1 CYP3A4 4828/4885CYP1A2 4636/4885CYP2C19 4833/4885
US-20240130367-A1 PLANT GROWTH PROMOTERS MYCBP, GLB1, GUSB CYP3A4 3021/4885CYP1A2 1310/4885CYP2C19 2543/4885

“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.