SCHEMBL4255887

SCHEMBL4255887

O=C(c1ncc(Cl)cc1Cl)N1CCC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPR P35270 2/20 0.51
LIPE Q05469 1/20 0.46
PDE4B Q07343 3/20 0.43
PDE4D Q08499 3/20 0.43
PDE4A P27815 1/20 0.43
PDE4C Q08493 1/20 0.43
GRM5 P41594 1/20 0.43
HPGD P15428 3/20 0.42
POLB P06746 1/20 0.42
TSHR P16473 1/20 0.42
CNR1 P21554 1/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HSP90AA1 P07900 1/20 0.41
HSD11B1 P28845 1/20 0.41
MAPT P10636 1/20 0.41
ALOX12 P18054 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL4259443 0.95 SPR (0.50) SPRLIPEGRM5HPGDPOLB
SCHEMBL4261653 0.86 HRH4 (0.53) SPRHPGDPOLBTSHRMEN1
SCHEMBL22865391 0.84 SPR (0.49) SPRLIPEPDE4BPDE4DPDE4A
SCHEMBL29703385 0.84 SPR (0.49) SPRLIPEPDE4BPDE4DPDE4A
SCHEMBL22865257 0.84 SPR (0.49) SPRLIPEPDE4BPDE4DPDE4A
SCHEMBL29661730 0.84 SPR (0.49) SPRLIPEPDE4BPDE4DPDE4A
SCHEMBL19171989 0.81 SPR (0.49) SPRLIPEGRM5HPGDPOLB
SCHEMBL18839478 0.81 HSD11B1 (0.50) SPRGRM5HPGDPOLBTSHR
SCHEMBL24016921 0.80 POLB (0.49) SPRPDE4BPDE4DPDE4APDE4C
SCHEMBL14303040 0.80 HSD11B1 (0.53) SPRGRM5HPGDPOLBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101511825-A Imidazol-pyrimidine derivatives for treatment of diseases related to glycogen synthase kinase (GSK3) ASTRAZENECA AB (SE) 2009-08-19 CN claimed
EP-2046782-A2 IMIDAZOLYLPYRIMIDINE DERIVATIVES FOR TREATMENT OF DISEASES RELATED TO GLYCOGEN SYNTHASE KINASE (GSK3) Astra Zeneca AB (SE) 2009-04-15 EP claimed
WO-2008002244-A2 IMIDAZOL-PYRIMIDINE DERIVATIVES FOR TREATMENT OF DISEASES RELATED TO GLYCOGEN SYNTHASE KINASE (GSK3) ASTRAZENECA AB (SE) 2008-01-03 WO claimed
CN-101511825-A Imidazol-pyrimidine derivatives for treatment of diseases related to glycogen synthase kinase (GSK3) ASTRAZENECA AB (SE) 2009-08-19 CN disclosed
EP-2046782-A2 IMIDAZOLYLPYRIMIDINE DERIVATIVES FOR TREATMENT OF DISEASES RELATED TO GLYCOGEN SYNTHASE KINASE (GSK3) Astra Zeneca AB (SE) 2009-04-15 EP disclosed
US-20080188502-A1 New Compounds I ASTRAZENECA AB (SE) 2008-08-07 US disclosed
US-20080188502-A1 New Compounds I ASTRAZENECA AB (SE) 2008-08-07 US disclosed
US-20080188502-A1 New Compounds I ASTRAZENECA AB (SE) 2008-08-07 US disclosed
WO-2008002244-A2 IMIDAZOL-PYRIMIDINE DERIVATIVES FOR TREATMENT OF DISEASES RELATED TO GLYCOGEN SYNTHASE KINASE (GSK3) ASTRAZENECA AB (SE) 2008-01-03 WO disclosed
WO-2008002244-A2 IMIDAZOL-PYRIMIDINE DERIVATIVES FOR TREATMENT OF DISEASES RELATED TO GLYCOGEN SYNTHASE KINASE (GSK3) ASTRAZENECA AB (SE) 2008-01-03 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 (1 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-20080188502-A1 New Compounds I SLC10A1, REN, SLC5A1 SPR 1770/4885LIPE 3893/4885PDE4B 222/4885

“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.