SCHEMBL1997252

SCHEMBL1997252

CCn1nc(C(=O)OC2CCc3ccccc32)cc(N)c1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.42
MAPK1 P28482 1/20 0.42
IDO1 P14902 2/20 0.39
STING1 Q86WV6 1/20 0.37
ALDH1A1 P00352 6/20 0.37
KDM4E B2RXH2 3/20 0.37
HPGD P15428 3/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PDE10A Q9Y233 1/20 0.36
FFAR1 O14842 2/20 0.36
HTT P42858 3/20 0.36
MAPT P10636 3/20 0.36
USP2 O75604 1/20 0.36
HTR2C P28335 1/20 0.36
OPRM1 P35372 1/20 0.36
DRD3 P35462 1/20 0.36
AVPR1A P37288 1/20 0.36
OPRK1 P41145 1/20 0.36
CTSV O60911 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
SCHEMBL1996126 0.78 KDM4C (0.36) GAAMAPK1STING1ALDH1A1KDM4E
SCHEMBL1997127 0.78 GAA (0.39) GAAMAPK1STING1ALDH1A1KDM4E
SCHEMBL5608071 0.73 TRPV1 (0.41) GAAMAPK1STING1
SCHEMBL2001144 0.72 MAPT (0.45) MAPK1ALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL1999700 0.70 ADORA3 (0.39) ALDH1A1HPGDLMNASMN1; SMN2MAPT
SCHEMBL11764887 0.69 IDO1 (0.51) IDO1ALDH1A1FFAR1HTTHTR2C
SCHEMBL2002767 0.69 CASP3 (0.43) ALDH1A1HTTMAPTMEN1KMT2A
SCHEMBL8558598 0.67 IDO1 (0.53) GAAIDO1ALDH1A1KDM4ELMNA
SCHEMBL817976 0.67 IDO1 (0.56) IDO1FFAR1HTR2COPRM1DRD3
SCHEMBL30908530 0.67 IDO1 (0.56) IDO1FFAR1HTR2COPRM1DRD3

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-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 GAA 1381/4885MAPK1 1255/4885IDO1 79/4885

“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.