SCHEMBL4707936

SCHEMBL4707936

CCn1nc(-c2ccccc2)cc(Nc2cccc(Cl)c2C)c1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 15/20 0.48
ADORA1 P30542 4/20 0.48
ADORA2A P29274 3/20 0.48
ADORA2B P29275 3/20 0.48
P2RX7 Q99572 2/20 0.45
MAPT P10636 2/20 0.44
MEN1 O00255 1/20 0.44
USP2 O75604 1/20 0.44
MT-CO2 P00403 1/20 0.44
LMNA P02545 1/20 0.44
TTR P02766 1/20 0.44
PLA2G1B P04054 1/20 0.44
CYP1A2 P05177 1/20 0.44
PGR P06401 1/20 0.44
CYP3A4 P08684 1/20 0.44
HTR1A P08908 1/20 0.44
ADRA2A P08913 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
AR P10275 1/20 0.44
CYP2C9 P11712 1/20 0.44

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
SCHEMBL4052278 0.81 PDE4B (0.48) PDE4BADORA1ADORA2AADORA2BMAPT
SCHEMBL4057070 0.81 TP53 (0.47) PDE4BADORA1ADORA2AADORA2BMAPT
SCHEMBL4055345 0.80 GAA (0.47) PDE4BADORA1ADORA2AADORA2B
SCHEMBL4054075 0.78 ACP1 (0.50) PDE4BADORA1ADORA2AADORA2BMAPT
SCHEMBL4052263 0.77 PDE4B (0.52) PDE4BADORA1ADORA2AADORA2B
SCHEMBL4052027 0.77 PDE4B (0.54) PDE4BP2RX7MEN1LMNAKMT2A
SCHEMBL4057455 0.76 ABCG2 (0.52) PDE4BADORA1ADORA2AADORA2BMAPT
SCHEMBL4051810 0.75 MAPT (0.48) PDE4BMAPTMEN1LMNAKMT2A
SCHEMBL4053981 0.75 PDE4B (0.39) PDE4BADORA1ADORA2AADORA2B
SCHEMBL4899705 0.75 PDE4B (0.63) PDE4BP2RX7MAPTMEN1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7459453-B2 Pyridazin-3(2H)-one derivatives as PDE4 inhibitors LABORATORIOS ALMIRALL, S.A. (ES) 2008-12-02 US disclosed
US-20060052379-A1 Pyridazin-3(2h)-one derivatives as pde4 inhibitors LABORATORIOS ALMIRALL, S.A. (ES) 2006-03-09 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 (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-20060052379-A1 Pyridazin-3(2h)-one derivatives as pde4 inhibitors PDE4A, PDE3A, PDE4B PDE4B 3/4885ADORA1 1116/4885ADORA2A 877/4885

“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.