SCHEMBL5584142

SCHEMBL5584142

Cc1cc(-c2cc(C(=O)O)c(=O)n(CCCc3c(Cl)cccc3Cl)n2)ccc1F

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 3/20 0.44
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
MAPT P10636 3/20 0.41
CNR2 P34972 7/20 0.41
TP53 P04637 1/20 0.40
RORC P51449 2/20 0.39
SRC P12931 1/20 0.38
CHRNA7 P36544 1/20 0.36

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
SCHEMBL5584596 0.91 PDE4B (0.41) PDE4BMAPTCNR2TP53SRC
SCHEMBL5584459 0.89 KMT2A (0.49) PDE4BMEN1KMT2AMAPTCNR2
SCHEMBL5584920 0.89 PDE4B (0.41) PDE4BMAPTCNR2TP53SRC
SCHEMBL5584394 0.87 CNR2 (0.43) PDE4BMAPTCNR2TP53
SCHEMBL5584862 0.85 KMT2A (0.43) PDE4BMEN1KMT2AMAPTCNR2
SCHEMBL5584166 0.83 CNR2 (0.45) PDE4BMEN1KMT2AMAPTCNR2
SCHEMBL5584857 0.82 CNR2 (0.46) PDE4BMEN1KMT2AMAPTCNR2
SCHEMBL1925446 0.81 CNR2 (0.49) PDE4BMEN1KMT2AMAPTCNR2
SCHEMBL5584513 0.80 CNR2 (0.53) PDE4BMEN1KMT2AMAPTCNR2
SCHEMBL5584875 0.79 KMT2A (0.39) PDE4BMEN1KMT2AMAPTTP53

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 5 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
US-6861428-B2 Water-soluble phenylpyridazine compounds and compositions containing the same KOWA CO., LTD. (JP) 2005-03-01 US disclosed
US-20040002497-A1 Water-soluble phenylpyridazine compounds and compositions containing the same KOWA CO., LTD. (JP) 2004-01-01 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 (2 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 2058/4885MEN1 4001/4885KMT2A 2387/4885
US-20040002497-A1 Water-soluble phenylpyridazine compounds and compositions containing the same IL1A, IL1B, IL1R1 PDE4B 3545/4885MEN1 4656/4885KMT2A 3413/4885

“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.