SCHEMBL1999844

SCHEMBL1999844

CCn1nc(C(=O)OCc2cccc(C(F)(F)F)c2)cc(Nc2cnccc2C)c1=O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.41
MMP12 P39900 1/20 0.41
PRKCA P17252 1/20 0.41
PRKCD Q05655 1/20 0.41
DDR1 Q08345 1/20 0.39
DDR2 Q16832 1/20 0.39
TRPV1 Q8NER1 3/20 0.39
P2RY14 Q15391 1/20 0.38
THRB P10828 1/20 0.38
PTGER1 P34995 1/20 0.38
NPY5R Q15761 1/20 0.37
MAPT P10636 1/20 0.37
PTGER3 P43115 1/20 0.37
STING1 Q86WV6 1/20 0.37
BRAF P15056 2/20 0.37
CSF1R P07333 1/20 0.37
NPBWR1 P48145 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 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
SCHEMBL1997464 0.88 TDP1 (0.40) MAPTMEN1KMT2A
SCHEMBL2000162 0.88 MAPT (0.44) MMP1MMP12PRKCAPRKCDDDR1
SCHEMBL1994497 0.87 MMP1 (0.41) MMP1MMP12P2RY14THRBMAPT
SCHEMBL1995154 0.85 TRPV1 (0.45) MMP1MMP12PRKCAPRKCDTRPV1
SCHEMBL2000314 0.85 SGMS2 (0.41)
SCHEMBL5606704 0.84 TRPV1 (0.42) MMP1MMP12PRKCAPRKCDTRPV1
SCHEMBL1994786 0.83 PDE4A (0.40) MAPTMEN1KMT2A
SCHEMBL2002231 0.83 KMT2A (0.42) TRPV1MAPTMEN1KMT2A
SCHEMBL1994456 0.81 KDM4C (0.36) MEN1KMT2A
SCHEMBL2826438 0.80 GPR52 (0.39) DDR1DDR2TRPV1P2RY14PTGER1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7960383-B2 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 SA (ES) 2011-06-14 US claimed
EP-1758869-B1 PYRIDAZIN-3(2H)-ONE DERIVATIVES AND THEIR USE AS PDE4 INHIBITORS ALMIRALL SA (ES) 2010-12-22 EP claimed
US-20080280918-A1 Pyridazin-3(2H)-One Derivatives and Their Use as Pde4 Inhibitors ALMIRALL PRODESFARMA, SA (ES) 2008-11-13 US claimed
US-7960383-B2 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 SA (ES) 2011-06-14 US disclosed
EP-1758869-B1 PYRIDAZIN-3(2H)-ONE DERIVATIVES AND THEIR USE AS PDE4 INHIBITORS ALMIRALL SA (ES) 2010-12-22 EP disclosed
US-20080280918-A1 Pyridazin-3(2H)-One Derivatives and Their Use as Pde4 Inhibitors ALMIRALL PRODESFARMA, SA (ES) 2008-11-13 US disclosed
EP-1758869-A1 PYRIDAZIN-3(2H)-ONE DERIVATIVES AND THEIR USE AS PDE4 INHIBITORS Almirall Prodesfarma, S.A. (ES) 2007-03-07 EP disclosed
WO-2005123692-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-20080280918-A1 Pyridazin-3(2H)-One Derivatives and Their Use as Pde4 Inhibitors PDE12, PDE4A, PDE4B MMP1 128/4885MMP12 345/4885PRKCA 1116/4885

“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.