SCHEMBL4772673

SCHEMBL4772673

CCOC(=O)CCc1c(CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)nc2c(cnn2CC)c1-c1cncc(C)c1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.33
POLB P06746 2/20 0.33
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
PDE4B Q07343 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.32
DHFR P00374 1/20 0.32
KDM4E B2RXH2 1/20 0.31
TP53 P04637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL4772478 0.87 KDM4E (0.41) ALDH1A1MEN1KMT2APDE4BSMN1; SMN2
SCHEMBL4776243 0.84 LMNA (0.35) ALDH1A1POLBMEN1KMT2APDE4B
SCHEMBL4778670 0.84 SLC16A3 (0.31) PDE4BSMN1; SMN2HPGD
SCHEMBL4778665 0.84 SLC16A3 (0.31) PDE4BSMN1; SMN2HPGD
SCHEMBL4772262 0.83 TSHR (0.41) ALDH1A1MEN1KMT2APDE4BSMN1; SMN2
SCHEMBL4772269 0.82 LMNA (0.36) ALDH1A1POLBMEN1KMT2APDE4B
SCHEMBL4778021 0.82 MAPT (0.31) TSHRNPSR1MAPT
SCHEMBL4776477 0.80 ALDH1A1 (0.35) ALDH1A1MEN1KMT2APDE4BSMN1; SMN2
SCHEMBL4774910 0.79 PDE4B (0.33) ALDH1A1MEN1KMT2APDE4BSMN1; SMN2
SCHEMBL4774921 0.79 PDE4B (0.34) ALDH1A1MEN1KMT2APDE4BSMN1; SMN2

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 ALDH1A1 774/4885POLB 1288/4885MEN1 3100/4885

“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.