SCHEMBL4056263

SCHEMBL4056263

CCn1nc(-c2ccc(C)cc2)c(C(=O)O)c(Nc2cnccc2C)c1=O

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.48
KDM4C Q9H3R0 4/20 0.43
ALDH1A1 P00352 1/20 0.39
RAB9A P51151 1/20 0.39
TBXAS1 P24557 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TP53 P04637 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
DHODH Q02127 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL4054444 0.93 PDE4B (0.56) PDE4BKDM4CTBXAS1SMN1; SMN2TP53
SCHEMBL3022923 0.92 PDE4B (0.52) PDE4BKDM4CALDH1A1RAB9ATBXAS1
SCHEMBL4052791 0.89 PDE4B (0.41) PDE4BKDM4CALDH1A1RAB9ATBXAS1
SCHEMBL3032862 0.87 PDE4B (0.65) PDE4BKDM4CTBXAS1SMN1; SMN2TP53
SCHEMBL4050885 0.87 PDE4B (0.43) PDE4BKDM4CTBXAS1SMN1; SMN2TP53
SCHEMBL1652356 0.86 PDE4B (0.63) PDE4BTBXAS1SMN1; SMN2TP53
SCHEMBL3036647 0.86 PDE4B (0.54) PDE4BKDM4CTBXAS1SMN1; SMN2TP53
SCHEMBL3039906 0.84 PDE4B (0.51) PDE4BKDM4CALDH1A1TBXAS1GAA
SCHEMBL4060223 0.84 PDE4B (0.55) PDE4BALDH1A1RAB9ATBXAS1SMN1; SMN2
SCHEMBL4052341 0.84 PDE4B (0.38) PDE4BKDM4CALDH1A1RAB9ATBXAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090029996-A1 phosphodiesterase enzyme inhibitor; 4-[(3-chlorophenyl)amino]-2-ethyl-5-(1-hydroxyethyl)-6-phenylpyridazin-3(2H)-one; potent antiinflammatory agent; asthma, atopic dermatitis, psoriasis, chronic obstructive pulmonary disease, rheumatoid arthritis, irritable bowel disease LABORATORIOS ALMIRALL, S.A. (ES) 2009-01-29 US disclosed
EP-1781621-A1 PYRIDAZIN-3(2H)-ONE DERIVATIVES AND THEIR USE AS PDE4 INHIBITORS Laboratorios Almirall, S.A. (ES) 2007-05-09 EP disclosed
WO-2005123693-A1 PYRIDAZIN-3(2H)-ONE DERIVATIVES AND THEIR USE AS PDE4 INHIBITORS LABORATORIOS ALMIRALL, S.A. (ES) 2005-12-29 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-20090029996-A1 phosphodiesterase enzyme inhibitor; 4-[(3-chlorophenyl)amino]-2-ethyl-5-(1-hydroxyethyl)-6-phenylpyridazin-3(2H)-one; potent antiinflammatory agent; asthma, atopic dermatitis, psoriasis, chronic obstructive pulmonary disease, rheumatoid arthritis, irritable bowel disease PDE12, PDE4A, PDE4B PDE4B 3/4885KDM4C 289/4885ALDH1A1 324/4885

“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.