SCHEMBL4594347

SCHEMBL4594347

O=c1[nH]cnc2c1oc1ccc(Cl)cc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 8/20 1.00
PIM3 Q86V86 5/20 1.00
PIM2 Q9P1W9 5/20 1.00
CDC7 O00311 5/20 1.00
CSNK2A1 P68400 4/20 1.00
GSK3B P49841 3/20 1.00
DYRK1A Q13627 3/20 1.00
IGF1R P08069 2/20 1.00
CLK2 P49760 2/20 1.00
GSK3A P49840 2/20 1.00
CLK4 Q9HAZ1 2/20 1.00
DYRK3 O43781 1/20 1.00
PKN2 Q16513 1/20 1.00
CSNK2B P67870 6/20 0.70
CSNK2A2 P19784 5/20 0.70
CSNK2A3 Q8NEV1 2/20 0.70
KDM4E B2RXH2 1/20 0.64
ALDH1A1 P00352 2/20 0.59
LMNA P02545 1/20 0.59
KMT2A Q03164 1/20 0.59

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
SCHEMBL4594776 0.82 PIM1 (0.70) PIM1PIM3PIM2CDC7CSNK2A1
SCHEMBL18496527 0.82 PIM1 (0.70) PIM1PIM3PIM2CDC7CSNK2A1
SCHEMBL12661345 0.82 PIM1 (1.00) PIM1PIM3PIM2CDC7CSNK2A1
SCHEMBL23610610 0.80 KDM4E (0.69) PIM1PIM3PIM2CDC7CSNK2A1
SCHEMBL31695354 0.79 PIM1 (0.66) PIM1PIM3PIM2CDC7CSNK2A1
SCHEMBL4593973 0.79 PIM1 (0.65) PIM1PIM3PIM2CDC7CSNK2A1
SCHEMBL1857738 0.78 KDM4E (1.00) PIM1PIM3PIM2CDC7CSNK2A1
SCHEMBL24055232 0.78 KDM4E (0.66) PIM1PIM3PIM2CDC7CSNK2A1
SCHEMBL31110304 0.78 KDM4E (0.66) PIM1PIM3PIM2CDC7CSNK2A1
SCHEMBL27164741 0.76 KDM4E (0.76) PIM1PIM3PIM2CDC7CSNK2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023217980-A1 COMBINATION THERAPY FOR CANCER COMPRISING A CDC7 INHIBITOR AND A CDK8 IN I HIBITOR OR A CCNC INHIBITOR NATIONAL UNIVERSITY OF IRELAND, GALWAY (IE) 2023-11-16 WO disclosed
US-20080269239-A1 Pyrimidine Compounds as Histamine Modulators ARGENTA DISCOVERY LTD. (GB) 2008-10-30 US disclosed
US-20080269239-A1 Pyrimidine Compounds as Histamine Modulators ARGENTA DISCOVERY LTD. (GB) 2008-10-30 US disclosed
US-20080269239-A1 Pyrimidine Compounds as Histamine Modulators ARGENTA DISCOVERY LTD. (GB) 2008-10-30 US disclosed
US-20080261946-A1 Pyrimidine Compounds for the Treatment of Inflammatory Disorders CELLZOME (UK) LTD. (GB) 2008-10-23 US disclosed
US-20080261946-A1 Pyrimidine Compounds for the Treatment of Inflammatory Disorders CELLZOME (UK) LTD. (GB) 2008-10-23 US disclosed
US-20080261946-A1 Pyrimidine Compounds for the Treatment of Inflammatory Disorders CELLZOME (UK) LTD. (GB) 2008-10-23 US disclosed
EP-1945646-A1 PYRIMIDINE COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS Cellzome (UK) Ltd. (GB) 2008-07-23 EP disclosed
EP-1812113-A1 PYRIMIDINE COMPOUNDS AS HISTAMINE MODULATORS Argenta Discovery Limited (GB) 2007-08-01 EP disclosed
EP-1776982-A1 Pyrimidine compounds as histamine modulators Argenta Discovery Limited (GB) 2007-04-25 EP disclosed
EP-1776982-A1 Pyrimidine compounds as histamine modulators Argenta Discovery Limited (GB) 2007-04-25 EP disclosed
WO-2007039467-A1 PYRIMIDINE COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS CELLZOME (UK) LTD. (GB) 2007-04-12 WO disclosed
WO-2007039467-A1 PYRIMIDINE COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS CELLZOME (UK) LTD. (GB) 2007-04-12 WO disclosed
EP-1767537-A1 Pyrimidine compounds for the treatment of inflammatory disorders Cellzome (UK) Ltd. (GB) 2007-03-28 EP disclosed
WO-2006050965-A1 PYRIMIDINE COMPOUNDS AS HISTAMINE MODULATORS ARGENTA DISCOVERY LTD (GB) 2006-05-18 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 (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-20080261946-A1 Pyrimidine Compounds for the Treatment of Inflammatory Disorders HRH4, HRH3, HRH2 PIM1 4157/4885PIM3 4362/4885PIM2 4175/4885
US-20080269239-A1 Pyrimidine Compounds as Histamine Modulators HRH4, HRH3, HRH2 PIM1 4244/4885PIM3 4334/4885PIM2 4258/4885

“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.