SCHEMBL4776452

SCHEMBL4776452

COCC(=O)/C(=C\c1cccc(Cl)c1)C(=O)OC

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.45
HPGD P15428 2/20 0.45
CYP2C19 P33261 1/20 0.45
FBP1 P09467 1/20 0.43
PTGS2 P35354 1/20 0.43
AKR1C3 P42330 1/20 0.41
CYP2C9 P11712 1/20 0.41
MAPT P10636 3/20 0.40
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GAA P10253 1/20 0.39

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
SCHEMBL4776457 1.00 CYP1A2 (0.45) CYP1A2HPGDCYP2C19FBP1PTGS2
SCHEMBL11739241 0.88 PTGS2 (0.54) CYP1A2CYP2C19FBP1PTGS2CYP2C9
SCHEMBL6960584 0.83 GLO1 (0.46) CYP1A2HPGDFBP1PTGS2CYP2C9
SCHEMBL6960592 0.83 GLO1 (0.46) CYP1A2HPGDFBP1PTGS2CYP2C9
SCHEMBL14508421 0.83 MEN1 (0.54) HPGDMAPT
SCHEMBL4506546 0.81 AKR1B10 (0.43) CYP1A2HPGDCYP2C19PTGS2MAPT
SCHEMBL11733751 0.81 GLO1 (0.61) FBP1MAPTSMN1; SMN2GAA
SCHEMBL4776016 0.80 LMNA (0.38) HPGDMAPTSMN1; SMN2
SCHEMBL4776010 0.80 LMNA (0.38) HPGDMAPTSMN1; SMN2
SCHEMBL6786973 0.80 MAPT (0.39) CYP1A2HPGDCYP2C19CYP2C9MAPT

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-7459451-B2 e.g. 1-Ethyl-4-(5-methyl-3-pyridyl)-6-phenyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid; phosphodiesterase (PDE)-IV inhibitor or tumor necrosis factor (TNF)- alpha antagonist; autoimmune diseases, antidepressant, anxiolytic agent; polychondritis, scleroderma, fibrosis, arthritis, Alzheimer's disease ASTELLAS PHARMA INC. (JP) 2008-12-02 US disclosed
EP-1763528-B1 PYRAZOLOPYRIDINE DERIVATIVES ASTELLAS PHARMA INC (JP) 2008-11-26 EP disclosed
EP-1763528-A1 PYRAZOLOPYRIDINE DERIVATIVES Astellas Pharma Inc. (JP) 2007-03-21 EP disclosed
WO-2006004188-A1 PYRAZOLOPYRIDINE DERIVATIVES ASTELLAS PHARMA INC. (JP) 2006-01-12 WO disclosed
US-20060004003-A1 Pyrazolopyridine derivatives ASTELLAS PHARMA INC. (JP) 2006-01-05 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 (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-20060004003-A1 Pyrazolopyridine derivatives PDE4A, PDE3B, PDE5A CYP1A2 450/4885HPGD 420/4885CYP2C19 864/4885

“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.