SCHEMBL3734876

SCHEMBL3734876

CN1CCN(Cc2cc3c(cn2)ncn3-c2cc(OCc3ccccc3C(F)(F)F)c(C(N)=O)s2)CC1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NEK2 P51955 5/20 0.68
PLK1 P53350 18/20 0.67
PLK3 Q9H4B4 4/20 0.67
SLK Q9H2G2 3/20 0.67
CSF1R P07333 3/20 0.67
KDR P35968 3/20 0.67
LIMK1 P53667 3/20 0.67
STK3 Q13188 3/20 0.67
DYRK1A Q13627 3/20 0.67
BRSK1 Q8TDC3 3/20 0.67
CLK4 Q9HAZ1 3/20 0.67
MAP4K5 Q9Y4K4 3/20 0.67
PIM1 P11309 3/20 0.67
PKN2 Q16513 3/20 0.67
MAP4K4 O95819 2/20 0.67
CAMK2B Q13554 2/20 0.67
CAMK2G Q13555 2/20 0.67
CAMK2D Q13557 2/20 0.67
PDGFRB P09619 2/20 0.67
KIT P10721 2/20 0.67

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
SCHEMBL3734761 0.94 PLK1 (0.67) NEK2PLK1PLK3SLKCSF1R
SCHEMBL3736088 0.90 PLK1 (0.57) NEK2PLK1PLK3SLKCSF1R
SCHEMBL3732003 0.87 PLK1 (0.77) NEK2PLK1PLK3SLKCSF1R
SCHEMBL3746566 0.86 PLK1 (0.81) NEK2PLK1PLK3SLKKDR
SCHEMBL3729338 0.86 PLK1 (0.81) NEK2PLK1PLK3SLKKDR
SCHEMBL3737356 0.86 PLK1 (0.81) NEK2PLK1PLK3SLKKDR
SCHEMBL3742272 0.86 PLK1 (0.72) NEK2PLK1PLK3SLKCSF1R
SCHEMBL3740658 0.85 PLK1 (0.57) NEK2PLK1PLK3SLKCSF1R
SCHEMBL3933141 0.85 PLK1 (0.78) NEK2PLK1PLK3SLKCSF1R
SCHEMBL3731227 0.84 PLK1 (0.73) NEK2PLK1PLK3SLKCSF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8273890-B2 Thiophene-imidazopyridines 4SC AG (DE) 2012-09-25 US claimed
US-20100278833-A1 THIOPHENE-IMIDAZOPYRIDINES 4SC AG (DE) 2010-11-04 US claimed
EP-2017277-A1 Thiophene-imidazopyridines 4SC AG (DE) 2009-01-21 EP claimed
WO-2009003911-A1 THIOPHENE-IMIDAZOPYRIDINES 4SC AG (DE) 2009-01-08 WO claimed
US-20250312347-A1 THERAPEUTIC BENEFIT OF SUBOPTIMALLY ADMINISTERED CHEMICAL COMPOUNDS BROWN DENNIS M (US) 2025-10-09 US disclosed
US-12336993-B2 Therapeutic benefit of suboptimally administered chemical compounds BROWN DENNIS M (US) 2025-06-24 US disclosed
US-20230133044-A1 THERAPEUTIC BENEFIT OF SUBOPTIMALLY ADMINISTERED CHEMICAL COMPOUNDS BROWN DENNIS M (US) 2023-05-04 US disclosed
US-11491154-B2 Therapeutic benefit of suboptimally administered chemical compounds BROWN DENNIS M (US) 2022-11-08 US disclosed
US-11446274-B2 Use of dianhydrogalactitol or derivatives or analogs thereof for treatment of pediatric central nervous system malignancies DEL MAR PHARMACEUTICALS (BC) LTD. (CA) 2022-09-20 US disclosed
US-20210251944-A1 METHODS FOR TREATING A CANCER RESISTANT TO AT LEAST ONE TYROSINE KINASE INHIBITOR DEL MAR PHARMACEUTICALS (BC) LTD. (CA) 2021-08-19 US disclosed
US-11026914-B2 Use of dianhydrogalactitol and analogs and derivatives thereof to treat recurrent malignant glioma or progressive secondary brain tumor DEL MAR PHARMACEUTICALS (BC) LTD. (CA) 2021-06-08 US disclosed
CN-112755193-A Method of treating malignancies with anti-tyrosine kinase inhibitors using dianhydrogalactitol or a derivative thereof 德玛医药 2021-05-07 CN disclosed
WO-2014168986-A1 THERAPEUTIC BENEFIT OF SUBOPTIMALLY ADMINISTERED CHEMICAL COMPOUNDS BROWN DENNIS M (US) 2014-10-16 WO disclosed
WO-2014004376-A2 METHODS FOR TREATING TYROSINE-KINASE-INHIBITOR-RESISTANT MALIGNANCIES IN PATIENTS WITH GENETIC POLYMORPHISMS OR AHI1 DYSREGULATIONS OR MUTATIONS EMPLOYING DIANHYDROGALACTITOL, DIACETYLDIANHYDROGALACTITOL, DIBROMODULCITOL, OR ANALOGS OR DERIVATIVES THEREOF DEL MAR PHARMACEUTICALS (CA) 2014-01-03 WO disclosed
US-8273890-B2 Thiophene-imidazopyridines 4SC AG (DE) 2012-09-25 US disclosed
US-20100278833-A1 THIOPHENE-IMIDAZOPYRIDINES 4SC AG (DE) 2010-11-04 US disclosed
EP-2170963-A2 NOVEL ADDUCTS USEFUL AS CURE COMPONENTS FOR ANAEROBIC CURABLE COMPOSITIONS Henkel Corporation (US) 2010-04-07 EP disclosed
WO-2009014688-A2 NOVEL ADDUCTS USEFUL AS CURE COMPONENTS FOR ANAEROBIC CURABLE COMPOSITIONS HENKEL CORPORATION (US) 2009-01-29 WO disclosed
EP-2017277-A1 Thiophene-imidazopyridines 4SC AG (DE) 2009-01-21 EP disclosed
WO-2009003911-A1 THIOPHENE-IMIDAZOPYRIDINES 4SC AG (DE) 2009-01-08 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 (8 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-20230133044-A1 THERAPEUTIC BENEFIT OF SUBOPTIMALLY ADMINISTERED CHEMICAL COMPOUNDS UNG, DPYD, TPMT NEK2 2269/4885PLK1 2427/4885PLK3 4321/4885
US-20250312347-A1 THERAPEUTIC BENEFIT OF SUBOPTIMALLY ADMINISTERED CHEMICAL COMPOUNDS UNG, DPYD, TPMT NEK2 2269/4885PLK1 2427/4885PLK3 4321/4885
US-11491154-B2 Therapeutic benefit of suboptimally administered chemical compounds UNG, DPYD, TPMT NEK2 2269/4885PLK1 2427/4885PLK3 4321/4885
US-11446274-B2 Use of dianhydrogalactitol or derivatives or analogs thereof for treatment of pediatric central nervous system malignancies DCK, CDC7, DNMT1 NEK2 576/4885PLK1 61/4885PLK3 1256/4885
US-20210251944-A1 METHODS FOR TREATING A CANCER RESISTANT TO AT LEAST ONE TYROSINE KINASE INHIBITOR DCLRE1B, AIPL1, WHR1 NEK2 1824/4885PLK1 514/4885PLK3 3854/4885
US-20100278833-A1 THIOPHENE-IMIDAZOPYRIDINES PIKFYVE, PIP4K2B, PIP5K1B NEK2 2328/4885PLK1 642/4885PLK3 1528/4885
US-12336993-B2 Therapeutic benefit of suboptimally administered chemical compounds UNG, DPYD, TPMT NEK2 2269/4885PLK1 2427/4885PLK3 4321/4885
US-11026914-B2 Use of dianhydrogalactitol and analogs and derivatives thereof to treat recurrent malignant glioma or progressive secondary brain tumor DDOST, DAD1, PHGDH NEK2 2741/4885PLK1 773/4885PLK3 2223/4885

“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.