SCHEMBL5584201

SCHEMBL5584201

COc1ccc(-c2cc(C(=O)O)c(=O)n(CCCc3ccccc3Cl)n2)cc1F

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 7/20 0.47
PDE4A P27815 6/20 0.47
PDE4C Q08493 6/20 0.47
PDE4D Q08499 6/20 0.47
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
DHODH Q02127 3/20 0.38
TP53 P04637 3/20 0.38
MDM2 Q00987 3/20 0.38
NPBWR1 P48145 1/20 0.38
CTSA P10619 1/20 0.37
P2RX7 Q99572 1/20 0.37

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
SCHEMBL5584623 0.87 PDE4A (0.46) PDE4BPDE4APDE4CPDE4DMEN1
SCHEMBL5584601 0.86 PDE4B (0.50) PDE4BPDE4APDE4CPDE4DDHODH
SCHEMBL5584596 0.86 PDE4B (0.41) PDE4BPDE4APDE4CPDE4DTP53
SCHEMBL5584246 0.85 PDE4A (0.46) PDE4BPDE4APDE4CPDE4DMEN1
SCHEMBL1925273 0.84 PDE4A (0.52) PDE4BPDE4APDE4CPDE4DTP53
SCHEMBL5584492 0.82 PDE4A (0.43) PDE4BPDE4APDE4CPDE4DMEN1
SCHEMBL5584457 0.81 PDE4A (0.42) PDE4BPDE4APDE4CPDE4DKMT2A
SCHEMBL1925813 0.79 TP53 (0.48) PDE4BPDE4APDE4CPDE4DMEN1
SCHEMBL1925297 0.78 TP53 (0.50) PDE4BPDE4APDE4CPDE4DMEN1
SCHEMBL5584142 0.78 PDE4B (0.44) PDE4BMEN1KMT2ATP53

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-7211577-B2 Water-soluble phenylpyridazine derivative and medicine containing the same KOWA CO., LTD. (JP) 2007-05-01 US disclosed
US-20060142292-A1 4-(4-tert-butoxycarbonyl-1-piperazinyl)methyl-6-(3-fluoro-4-methylphenyl)-2-isobutyl-2H-pyridazin-3-one;inhibiting interleukin-1 beta, high water solubility and oral absorbability; treating immune system diseases, inflammatory diseases, and ischemic diseases KOWA CO., LTD. (JP) 2006-06-29 US disclosed
EP-1604984-A1 WATER-SOLUBLE PHENYLPYRIDAZINE DERIVATIVE AND MEDICINE CONTAINING THE SAME Kowa Co., Ltd. (JP) 2005-12-14 EP 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-20060142292-A1 4-(4-tert-butoxycarbonyl-1-piperazinyl)methyl-6-(3-fluoro-4-methylphenyl)-2-isobutyl-2H-pyridazin-3-one;inhibiting interleukin-1 beta, high water solubility and oral absorbability; treating immune system diseases, inflammatory diseases, and ischemic diseases IL1B, IL1A, IL1R1 PDE4B 2058/4885PDE4A 1624/4885PDE4C 3148/4885

“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.