SCHEMBL18644752

SCHEMBL18644752

O=C(c1nc2cccnn2c1-c1ccc(Cl)c(F)c1)N1CCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 1.00
PDE4D Q08499 19/20 1.00
PDE4A P27815 17/20 1.00
PDE4C Q08493 16/20 1.00

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
SCHEMBL18644797 0.90 PDE4B (1.00) PDE4BPDE4DPDE4APDE4C
SCHEMBL18644772 0.90 PDE4B (1.00) PDE4BPDE4DPDE4APDE4C
SCHEMBL18644769 0.89 PDE4B (1.00) PDE4BPDE4DPDE4APDE4C
SCHEMBL17508935 0.86 PDE4B (1.00) PDE4BPDE4DPDE4APDE4C
SCHEMBL18644800 0.85 PDE4B (1.00) PDE4BPDE4DPDE4APDE4C
SCHEMBL18644775 0.85 PDE4B (1.00) PDE4BPDE4DPDE4APDE4C
SCHEMBL18644753 0.85 PDE4B (1.00) PDE4BPDE4DPDE4APDE4C
SCHEMBL17492382 0.85 PDE4B (1.00) PDE4BPDE4DPDE4APDE4C
SCHEMBL17492374 0.85 PDE4D (0.76) PDE4BPDE4DPDE4APDE4C
SCHEMBL17508925 0.84 PDE4B (1.00) PDE4BPDE4DPDE4APDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10077269-B2 Imidazopyridazine compounds PFIZER INC. (US) 2018-09-18 US claimed
US-20170145022-A1 Imidazopyridazine Compounds PFIZER INC. (US) 2017-05-25 US claimed
US-10669279-B2 Imidazopyridazine compounds PFIZER INC. (US) 2020-06-02 US disclosed
US-20190322674-A1 IMIDAZOPYRIDAZINE COMPOUNDS PFIZER (US) 2019-10-24 US disclosed
EP-3177624-B1 IMIDAZOPYRIDAZINE COMPOUNDS PFIZER (US) 2019-05-01 EP disclosed
US-10077269-B2 Imidazopyridazine compounds PFIZER INC. (US) 2018-09-18 US disclosed
US-20170145022-A1 Imidazopyridazine Compounds PFIZER INC. (US) 2017-05-25 US disclosed
US-20170145022-A1 Imidazopyridazine Compounds PFIZER INC. (US) 2017-05-25 US disclosed
US-20170145022-A1 Imidazopyridazine Compounds PFIZER INC. (US) 2017-05-25 US disclosed
US-9598421-B2 Imidazopyridazine compounds PFIZER INC. (US) 2017-03-21 US disclosed
US-9598421-B2 Imidazopyridazine compounds PFIZER INC. (US) 2017-03-21 US 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 (4 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-10077269-B2 Imidazopyridazine compounds CYP3A5, QDPR, CYP3A7 PDE4B 206/4885PDE4D 443/4885PDE4A 306/4885
US-20170145022-A1 Imidazopyridazine Compounds CYP3A5, QDPR, CYP3A7 PDE4B 206/4885PDE4D 443/4885PDE4A 306/4885
US-20190322674-A1 IMIDAZOPYRIDAZINE COMPOUNDS CYP3A5, QDPR, CYP3A7 PDE4B 206/4885PDE4D 443/4885PDE4A 306/4885
US-10669279-B2 Imidazopyridazine compounds CYP3A5, QDPR, CYP3A7 PDE4B 206/4885PDE4D 443/4885PDE4A 306/4885

“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.